Schultz, T.W.; Cronin, M.T.D.; Netzeva, T.I.; Aptula, A.O. Structure-Toxicity Relationships for Aliphatic Chemicals Evaluated with Tetrahymena pyriformis. Chem. Res. Toxicol. 2002, 15, 12, 1602–1609.

500 compounds | Property pIGC50: 40-h Tetrahymena toxicity as log(1/IGC50) [log(L/mmol)]

ID	Name	pIGC50	Details
1	methyl alcohol	-2.6656	View
2	ethyl alcohol	-1.9912	View
3	1-propanol	-1.7464	View
4	2-propanol)	-1.8819	View
5	1-butanol	-1.4306	View
6	(+/-)-2-butanol	-1.5420	View
7	2-methyl-1-propanol	-1.3724	View
8	1-pentanol	-1.0304	View
9	2-pentanol	-1.1596	View
10	3-pentanol	-1.2437	View
11	3-methyl-2-butanol	-0.9959	View
12	tert-amylalcohol	-1.1729	View
13	2-methyl-1-butanol	-0.9528	View
14	3-methyl-1-butanol	-1.0359	View
15	2,2-dimethyl-1-propanol	-0.8702	View
16	2-methyl-2-propanol	-1.7911	View
17	2-butoxyethanol	-1.3743	View
18	1-hexanol	-0.3789	View
19	3,3-dimethyl-1-butanol	-0.7368	View
20	4-methyl-1-pentanol	-0.6372	View
21	1-heptanol	0.1050	View
22	2,4-dimethyl-3-pentanol	-0.7052	View
23	1-octanol	0.5827	View
24	2-octanol	0.0011	View
25	3-octanol	0.0309	View
26	2-ethyl-1-hexanol	0.1673	View
27	2-propyl-1-pentanol	0.1344	View
28	1-nonanol	0.8551	View
29	2-nonanol	0.6183	View
30	3-ethyl-2,2-dimethyl-3-pentanol	-0.1691	View
31	1-decanol	1.3354	View
32	(+/-)-4-decanol	0.8499	View
33	3,7-dimethyl-3-octanol	0.3404	View
34	1-undecanol	1.9547	View
35	1-dodecanol	2.1612	View
36	1-tridecanol	2.4497	View
37	Cyclohexanol	-0.7659	View
38	(+/-)-1,2-butanediol	-2.0482	View
39	(+/-)-1,3-butanediol	-2.3013	View
40	1,4-butanediol	-2.2365	View
41	1,2-pentanediol	-1.6269	View
42	1,5-pentanediol	-1.9344	View
43	2-methyl-2,4-pentanediol	-1.9531	View
44	(+/-)-1,2-hexanediol	-1.2669	View
45	1,6-hexanediol	-1.4946	View
46	2,5-hexanediol	-1.9598	View
47	1,2-decanediol	0.7640	View
48	1,10-decanediol	0.2240	View
49	3-buten-1-ol	-1.6952	View
50	3-methyl-3-buten-1-ol	-1.1848	View
51	2-methyl-3-buten-2-ol	-1.3889	View
52	4-penten-1-ol	-1.2151	View
53	4-penten-2-ol	-1.5172	View
54	4-pentyn-1-ol	-1.4204	View
55	2-methyl-3-butyn-2-ol	-1.3114	View
56	trans-3-hexen-1ol	-0.7772	View
57	cis-3-hexen-1-ol	-0.8091	View
58	5-hexyn-1-ol	-1.2948	View
59	3-methyl-1-pentyn-3-ol	-1.3226	View
60	4-methyl-2-heptyn-4-ol	-0.4815	View
61	2,5-dimethyl-3-hexyne-2,5-diol	-1.5849	View
62	3,5-dimethyl-1-hexyne-3-ol	-0.5530	View
63	4-hexen-1-ol	-0.7540	View
64	5-hexen-1-ol	-0.8411	View
65	3-butyn-1-ol	-1.8390	View
66	3-pentyn-1-ol	-1.1750	View
67	(+/-)-4-pentyn-2-ol	-1.6324	View
68	3-hexyn-1-ol	-1.0243	View
69	5-hexyn-3-ol	-1.4043	View
70	3-heptyn-1-ol	-0.3231	View
71	4-heptyn-2-ol	-0.6160	View
72	3-octyn-1-ol	0.0170	View
73	5-octyn-3-ol	-0.3759	View
74	5-nonyl-3-ol (TECH.)	-0.0425	View
75	3-nonyn-1-ol	0.3401	View
76	3-decyn-1-ol	1.1273	View
77	3-tetradecyn-1-ol	2.3768	View
78	2-propen-1-ol	-1.9178	View
79	2-buten-1-ol	-1.4719	View
80	2-methyl-2-propen-1-ol	-1.6628	View
81	(+/-)-3-buten-2-ol	-1.0529	View
82	cis-2-buten-1,4-diol	-2.1495	View
83	3-methyl-2-buten-1-ol	-1.2392	View
84	cis-2-penten-1-ol	-1.1052	View
85	3-penten-2-ol	-1.4010	View
86	1-penten-3-ol	-1.3475	View
87	trans-2-hexen-1-ol	-0.4718	View
88	1-hexen-3-ol	-0.8113	View
89	cis-2-hexen-1-ol	-0.7767	View
90	trans-2-hepten-1-ol	0.0452	View
91	trans-2-octen-1-ol	0.3654	View
92	cis-2-nonen-1-ol	0.7701	View
93	trans-2-nonen-1-ol	0.7520	View
94	2-decen-1-ol	1.1284	View
95	trans-2-undecen-1-ol	1.6108	View
96	2-dodecen-1-ol	2.0915	View
97	methyl acetate	-1.5954	View
98	ethyl acetate	-1.2968	View
99	propyl acetate	-1.2382	View
100	isopropyl acetate	-1.5900	View
101	butyl acetate	-0.4864	View
102	(+/-)-sec-butyl acetate	-0.6794	View
103	amyl acetate	0.1625	View
104	hexyl acetate	-0.0087	View
105	2-ethylbutyl acetate	-0.1202	View
106	octyl acetate	1.0570	View
107	decyl acetate	1.8794	View
108	ethyl propionate	-0.9450	View
109	butyl propionate	0.1704	View
110	isobutyl propionate	-0.6935	View
111	propyl propionate	-0.8148	View
112	tert butyl propionate	-0.4095	View
113	ethyl butyrate	-0.4903	View
114	ethyl isobutyrate	-1.2709	View
115	(+/-)-ethyl-2-methylbutyrate	-0.8893	View
116	ethyl valerate	-0.3580	View
117	ethyl isovalerate	-0.7231	View
118	propyl butyrate	-0.4138	View
119	butyl butyrate	0.5157	View
120	propyl valerate	0.0094	View
121	amyl propionate	-0.0431	View
122	isobutyl isobutyrate	-0.5908	View
123	ethyl hexanoate	0.0637	View
124	methyl propionate	-1.6092	View
125	methyl butyrate	-1.2463	View
126	methyl valerate	-0.8448	View
127	(+/-)-methyl-2-methylbutyrate	-1.1650	View
128	methyl hexanoate	-0.5611	View
129	methyl heptanoate	0.1039	View
130	methyl octanoate	0.5358	View
131	methyl nonanoate	1.0419	View
132	methyl decanoate	1.3778	View
133	methyl undecanoate	1.4248	View
134	methyl formate	-1.4982	View
135	propyl formate	-1.0221	View
136	butyl formate	-0.9336	View
137	isobutyl formate	-1.3081	View
138	tert butyl formate	-1.3719	View
139	n-hexyl formate	-0.3824	View
140	n-amyl formate	-0.7826	View
141	allyl propionate	-0.8791	View
142	allyl butyrate	-0.6355	View
143	allyl hexanoate	0.2128	View
144	allyl heptanoate	0.7282	View
145	isopropenyl acetate	-0.4892	View
146	vinyl acetate	-0.8595	View
147	vinyl-2-ethylhexanoate	1.0462	View
148	propargyl acetate	-1.1664	View
149	propargyl propionate	-0.6554	View
150	vinyl propionate	-0.6530	View
151	vinyl butyrate	-0.3825	View
152	methyl trans-3-pentenoate	-0.2761	View
153	2-butynyl acetate	-0.8834	View
154	acetone	-2.2036	View
155	2-butanone	-1.7457	View
156	2-pentanone	-1.2224	View
157	3-pentanone	-1.4561	View
158	3-methyl-2-butanone	-1.1689	View
159	2-hexanone	-1.3435	View
160	4-methyl-2-pentanone	-1.2085	View
161	cyclohexanone	-1.2333	View
162	3,3-dimethyl-2-butanone	-1.4420	View
163	2-heptanone	-0.4872	View
164	5-methyl-2-hexanone	-0.6459	View
165	4-heptanone	-0.6690	View
166	2-octanone	-0.1455	View
167	2-nonanone	0.6598	View
168	5-nonanone	0.0744	View
169	2-decanone	0.5822	View
170	3-decanone	0.6265	View
171	2-undecanone	1.5346	View
172	2-dodecanone	1.6696	View
173	2-tridecanone	2.1192	View
174	7-tridecanone	1.5214	View
175	5-hexen-2-one	-1.1405	View
176	5-methyl-5-hexen-2-one	-0.8749	View
177	6-methyl-5-hepten-2-one	-0.4523	View
178	methyl cyanide	-2.2769	View
179	ethyl cyanide	-1.9721	View
180	propyl cyanide	-1.4409	View
181	isopropyl cyanide	-1.6193	View
182	butyl cyanide	-1.0071	View
183	isobutyl cyanide	-0.8764	View
184	tert-butyl cyanide	-1.3255	View
185	pentyl cyanide	-0.3758	View
186	isopentyl cyanide	-0.7860	View
187	hexyl cyanide	-0.2373	View
188	heptyl cyanide	0.2834	View
189	octyl cyanide	0.6247	View
190	decyl cyanide	1.6498	View
191	undecyl cyanide	1.9031	View
192	allyl cyanide	-1.4792	View
193	trans-3-pentenitrile	-0.9528	View
194	1-bromobutane	-0.1802	View
195	1-bromopentane	0.4839	View
196	1-bromohexane	0.9370	View
197	1-bromoheptane	1.4868	View
198	1-bromooctane	1.8697	View
199	1,2-dibromohexane	1.1457	View
200	1,6-dibromohexane	1.0460	View
201	3,4-dibromohexane	0.9978	View
202	propyl sulfide	-0.0029	View
203	butyl sulfide	1.0400	View
204	1-heptanethiol	1.0200	View
205	1,6-hexanedithiol	0.6261	View
206	cyclohexyl mercaptan	-0.0040	View
207	1,8-octanedithiol	1.1911	View
208	dimethylsulfoxide	-2.4518	View
209	n-propylsulfoxide	-1.2205	View
210	butyl sulfoxide	-0.2567	View
211	di-n-propyl sulfite	0.0861	View
212	butyl sulfone	-0.2563	View
213	diethyl sulfate	-0.6977	View
214	di-n-butyl sulfate	0.6207	View
215	acetaldoxime	-1.6100	View
216	acetone oxime	-1.2485	View
217	2-butanone oxime	-1.0697	View
218	cyclohexanone oxime	-0.7963	View
219	2-heptanone oxime	0.1025	View
220	methyl carbamate	-1.9749	View
221	ethyl carbamate	-1.6500	View
222	n-butylcarbamate	-0.9663	View
223	diethyl malonate	-0.9975	View
224	diethyl sebaccate	1.3536	View
225	diethyl suberate	0.7018	View
226	diethyl succinate	-0.8511	View
227	dimethyl malonate	-1.2869	View
228	dibutyl adipate	0.7918	View
229	dimethyl succinate	-1.0573	View
230	diethyl adipate	-0.1265	View
231	dimethyl brassylate	1.6536	View
232	dimethyl sebaccate	1.0106	View
233	dimethyl suberate	0.2962	View
234	dimethyl glutarate	-1.1679	View
235	diethyl pimelate	0.4069	View
236	dibutyl suberate	1.6556	View
237	diethyl isopropylidene malonate	-0.0728	View
238	diethyl butylmalonate	0.5566	View
239	diethyl ethylmalonate	-0.2422	View
240	diethyl-3-oxopimelate	-0.3778	View
241	diethyl-4-oxopimelate	-0.6378	View
242	diethyl methylmalonate	-0.5114	View
243	diethyl propylmalonate	0.1341	View
244	diethyl acetamidomalonate	-1.2037	View
245	diethyl allylmalonate	-0.0559	View
246	dibutyl succinate	0.5123	View
247	propionic acid sodium salt	-1.4503	View
248	butyric acid,sodium salt	-1.3722	View
249	hexanoic acid sodium salt	-0.6802	View
250	octanoic acid sodium salt	-0.0796	View
251	malonic acid disodium salt monohydrate	-1.5780	View
252	succinic acid disodium salt	-1.6510	View
253	propionaldehyde	-0.4855	View
254	butyraldehyde	-0.3805	View
255	isobutyraldehyde	-0.4328	View
256	valeraldehyde	-0.0223	View
257	2-methyl-buteraldehyde	-0.3107	View
258	hexylaldehyde	-0.1731	View
259	2-methylvaleraldehyde	-0.4745	View
260	2-ethylbutyraldehyde	-0.0544	View
261	3,3-dimethyl butyraldehyde	-0.3744	View
262	heptaldehyde	-0.0019	View
263	octyl aldehyde	0.4829	View
264	2-ethylhexanal	0.1608	View
265	nonyl aldehyde	0.8080	View
266	decyl aldehyde	1.2815	View
267	undecylic aldehyde	1.6904	View
268	dodecyl aldehyde	1.7595	View
269	trans-4-decen-1-al	1.2076	View
270	cis-7-decen-1-al	0.9485	View
271	β-propiolactone (TECH)	-0.1255	View
272	γ-butyrolactone	-1.7171	View
273	(+/-)-β-butyrolactone	-0.7588	View
274	γ-valerolactone	-1.5691	View
275	γ-caprolactone	-1.2403	View
276	ε-caprolactone	-1.2609	View
277	α-methyl-δ-butyrolactone	-1.1897	View
278	γ-octanoic lactone	-0.3798	View
279	γ -nonanoic lactone	0.0142	View
280	γ -decanolactone	0.4928	View
281	(+/-)-δ-decanolactone	-0.0773	View
282	2-propyn-1-ol	-1.0738	View
283	2-butyn-1-ol	-0.8678	View
284	3-butyn-2-ol	-0.4024	View
285	2-butyn-1,4-diol	-1.8836	View
286	1-pentyn-3-ol	-1.1776	View
287	2-pentyn-1-ol	-0.5724	View
288	2-penten-4-yn-1-ol	-0.5549	View
289	1-hexyn-3-ol	0.6574	View
290	2-hexyn-1-ol	-0.3840	View
291	3-hexyn-2-ol	0.5112	View
292	4-hexyn-3-ol	-0.1949	View
293	3-hexyne-2,5-diol	-0.4604	View
294	1-heptyn-3-ol	-0.2650	View
295	2-heptyn-1-ol	-0.1895	View
296	4-heptyn-3-ol	-0.0336	View
297	2-octyn-1-ol	0.1944	View
298	2-nonyn-1-ol	0.6486	View
299	2-decyn-1-ol	0.9855	View
300	2-tridecyn-1-ol	2.3665	View
301	4-methyl-1-pentyn-3-ol	-0.0267	View
302	5-methyl-1-hexyn-3-ol	0.6173	View
303	4-methyl-1-heptyn-3-ol	0.7426	View
304	2-methyl-5-octyn-4-ol	0.4011	View
305	2-bromoethanol	-0.8457	View
306	3-bromo-1-propanol	-0.9328	View
307	2-chloroethanol	-1.4174	View
308	1-chloro-2-propanol	-1.4920	View
309	3-chloro-1-propanol	-1.3992	View
310	4-chloro-1-butanol	-0.7594	View
311	3-chloro-2,2-dimethyl-1-propanol	-0.7822	View
312	2,2-dichloroethanol	-0.9904	View
313	2,2,2-trichloroethanol	-0.4647	View
314	1,3-dichloro-2-propanol	-0.7930	View
315	6-chloro-1-hexanol	-0.2726	View
316	8-chloro-1-octanol	0.4878	View
317	6-bromo-1-hexanol	0.0074	View
318	8-bromo-1-octanol	1.0424	View
319	2,2,2-tribromoethanol	0.1127	View
320	3-bromo-2,2-dimethyl-1-propanol	-0.4603	View
321	1-bromo-2-propanol (TECH.)	-1.1885	View
322	2,3-dibromopropanol	-0.4861	View
323	4-bromobutylacetate	0.3923	View
324	5-chloropentylacetate	-0.1312	View
325	methyl-5-bromovalerate	-0.0802	View
326	5-bromopentylacetate	0.2933	View
327	ethyl-5-bromovalerate	0.2177	View
328	ethyl-6-bromohexanoate	0.5936	View
329	ethyl-3-bromopropionate	0.1263	View
330	ethyl 3-chloropropionate	-0.4980	View
331	ethyl 4-chlorobutyrate	-0.2809	View
332	ethyl-4-bromobutyrate	-0.0290	View
333	4-bromobutyronitrile	-0.4655	View
334	5-bromovaleronitrile	-0.2147	View
335	7-bromoheptanonitrile	0.5120	View
336	3-chloropropionitrile	-0.9986	View
337	4-chlorobutyronitrile	-0.9303	View
338	5-chlorovaleronitrile	-0.6345	View
339	7-chloroheptanonitrile	0.2868	View
340	4-bromobutyric acid (non-neutralized)	-0.7711	View
341	5-bromovaleric acid (non-neutralized)	-0.6929	View
342	8-bromooctanoic acid (non-neutralized)	1.3233	View
343	6-bromohexanoic acid (non-neutralized)	0.0305	View
344	3-bromopropionic acid (non-neutralized)	-0.0444	View
345	4-chlorobutyric acid (non-neutralized)	-0.6773	View
346	3-chloropropionic acid (non-neutralized)	-0.3321	View
347	5-chlorovaleric acid (non-neutralized)	-0.2857	View
348	2-bromobutyric acid (non-neutralized)	0.1221	View
349	2-bromoisobutyric acid (non-neutralized)	-0.5845	View
350	2-bromoisovaleric acid (non-neutralized)	-0.5492	View
351	2-bromovaleric acid (non-neutralized)	-0.0423	View
352	2-bromooctanoic acid (non-neutralized)	0.4907	View
353	2-bromohexanoic acid (non-neutralized)	0.4547	View
355	acetic hydrazide	-1.3796	View
356	butyric acid hydrazide	-0.9720	View
357	adipic dihydrazide	-1.3744	View
354	formylhydrazine	-0.8708	View
358	succinonitrile	-1.8236	View
359	glutaronitrile	-1.6375	View
360	1,4-dicyanobutane	-1.5381	View
361	2,4-pentanedione	-0.2721	View
362	1,3-cyclohexanedione (neutralized)	-0.9290	View
363	1,4-cyclohexanedione	-1.6677	View
364	2,5-hexanedione	-1.4034	View
365	3,5-heptanedione	-0.3816	View
366	2,4-octanedione	0.1298	View
367	2,4-nonanedione	0.5058	View
368	ethanolamine (neutralized)	-1.8855	View
369	3-amino-1-propanol (neutralized)	-1.6917	View
370	2-(methylamino) ethanol (neutralized)	-1.8202	View
371	4-amino-1-butanol (non-neutralized)	-0.9752	View
372	2-(ethylamino)ethanol (neutralized)	-1.6491	View
373	2-amino-2-methyl-propanol (neutralized)	-1.9315	View
374	5-amino-1-pentanol (neutralized)	-1.7649	View
375	2-(propylamino) ethanol (neutralized)	-1.6842	View
376	DL-2-amino-1-pentanol (non-neutralized)	-0.6718	View
377	3-amino-2,2-dimethyl-1-propanol (non-neutralized)	-0.9246	View
378	6-amino-1-hexanol (non-neutralized)	-0.9580	View
379	DL-2-amino-1-hexanol TECH (non-neutralized)	-0.5848	View
380	DL-2-amino-3-methyl-1-butanol (non-neutralized)	-0.5852	View
381	2-amino-3,3-dimethyl-butanol (non-neutralized)	-0.7178	View
382	2-amino-3-methyl-1-pentanol (non-neutralized)	-0.6594	View
383	2-amino-4-methyl-pentanol (non-neutralized)	-0.6191	View
384	N,N-(neutralized) diethylethanolamine (neutralized)	-1.4955	View
385	2-(tert.butylamino) ethano l (neutralized)	-1.6730	View
386	diethanolamine (neutralized)	-1.7941	View
387	(+/-)-3-amino-1,2-pro-panediol (neutralized)	-1.8124	View
388	1,3-diamino-2-hydroxy -propane (neutralized)	-1.4275	View
389	2-amino-1,3-pro-panediol (neutralized)	-1.6763	View
390	N-methyldiethanol amine (neutralized)	-1.8338	View
391	3-(methylamino)-1,2-propanediol (neutralized)	-1.5341	View
392	triethanolamine (non-neutralized)	-1.7488	View
393	propylamine	-0.7075	View
394	butylamine	-0.5735	View
395	n-methylpropylamine	-0.8087	View
396	amylamine	-0.4848	View
397	n-methylbutylamine	-0.6784	View
398	hexylamine	-0.2197	View
399	heptylamine	0.2109	View
400	octylamine	0.3509	View
401	nonylamine	1.7011	View
402	decylamine	2.0555	View
403	undecylamine	2.3279	View
404	isopropylamine	-0.8635	View
405	isobutylamine	-0.2616	View
406	n,n-dimethylethylamine	-0.9083	View
407	(+/-)-secbutylamine	-0.6708	View
408	isoamylamine	-0.5774	View
409	1-methylbutylamine	-0.6846	View
410	1-ethylpropylamine	-0.8129	View
411	2-methylbutylamine	-0.4774	View
412	n,n-diethylmethylamine	-0.7559	View
413	tert-butylamine	-0.8973	View
414	tert-amylamine	-0.6978	View
415	(+/-)-1,2-dimethyl-propylamine	-0.7095	View
416	propargylamine	-0.8260	View
417	n-methylpropargylamine	-0.9818	View
418	1-dimethylamino-2-propyne	-1.1451	View
419	1,1-dimethylpro pargylamine	-0.9104	View
420	2-methoxyethylamine (neutralized)	-1.7903	View
421	3-methoxypropylamine (neutralized)	-1.7725	View
422	3-ethoxypropylamine (neutralized)	-1.7027	View
423	(+/-)-2-amino-1-methoxy propane (non-neutralized)	-0.8332	View
424	1,3-diaminopropane	-0.7045	View
425	propionic acid (non-neutralized)	-0.5123	View
426	butyric acid (non-neutralized)	-0.5720	View
427	valeric acid (non-neutralized)	-0.2674	View
428	hexanoic acid (non-neutralized)	-0.2083	View
429	heptanoic acid (non-neutralized)	-0.1126	View
430	octanoic acid (non-neutralized)	0.0807	View
431	nonanoic acid (non-neutralized)	0.3509	View
432	decanoic acid (non-neutralized)	0.5063	View
433	undecanoic acid (non-neutralized)	0.8983	View
434	isobutyric acid (non-neutralized)	-0.3334	View
435	isovaleric acid (non-neutralized)	-0.3415	View
436	trimethylacetic acid (non-neutralized)	-0.2543	View
437	3-methylvaleric acid (non-neutralized)	-0.2331	View
438	4-methylvaleric acid (non-neutralized)	-0.2724	View
439	2-ethylbutyric acid (non-neutralized)	-0.1523	View
440	2-propylpentanoic acid	0.0258	View
441	2-ethylhexanoic acid (non-neutralized)	0.0756	View
442	vinylacetic acid	-0.6424	View
443	trans-3-hexenoic acid (non-neutralized)	-0.2222	View
444	malonic acid (non-neutralized)	-0.7087	View
445	succinic acid (non-neutralized)	-0.9395	View
446	glutaric acid (non-neutralized)	-0.6387	View
447	adipic acid (non-neutralized)	-0.6060	View
448	pimelic acid (non-neutralized)	-0.5845	View
449	3,3-dimethylglutaric acid (non-neutralized)	-0.6643	View
450	suberic acid (non-neutralized)	-0.5116	View
451	sebacic acid (non-neutralized)	-0.2676	View
452	1,10-decanedicar boxylic acid (non-neutralized)	-0.0863	View
453	crotonic acid (non-neutralized)	-0.5448	View
454	trans-2-pentenoic acid (non-neutralized)	-0.2774	View
455	trans-2-hexenoic acid (non-neutralized)	-0.1279	View
456	2-octenoic acid (non-neutralized)	0.2089	View
457	trans-2-nonenoic acid (non-neutralized)	0.5995	View
458	propiolic acid (non-neutralized)	-0.2942	View
459	2-octynoic acid (non-neutralized)	-0.0570	View
460	α-nonynoic acid (non-neutralized)	0.7138	View
461	ethylisothiocyanate	1.6271	View
462	propylisothiocyanate	1.6925	View
463	butyl isothiocyanate	1.7212	View
464	amylisothiocyanate	1.7055	View
465	hexylisothiocyanate	1.7496	View
466	tert-amylisothiocyanate	0.3529	View
467	allyl isothiocyanate	2.0605	View
468	1,3-propylene diisothiocyanate	2.7212	View
469	valeryl chloride	-0.3447	View
470	hexanoyl chloride	0.3395	View
471	heptanoyl chloride	0.4592	View
472	octanoyl chloride	0.4149	View
473	ethyl-2-bromovalerate	0.6985	View
474	ethyl-2-bromohexanoate	0.8601	View
475	ethyl-2-bromopropionate	1.0570	View
476	methyl-2-bromobutyrate	1.0241	View
477	ethyl-2-bromobutyrate	0.7640	View
478	ethyl 2,3-dibromopropionate	2.2076	View
479	ethyl 2,3-dibromobutyrate	1.4377	View
480	ethyl 2-bromoisovalerate	0.0205	View
481	ethyl 2-bromooctanoate	1.4989	View
482	ethyl 2-chloropropionate	-0.4312	View
483	diethyl chloromalonate	0.6345	View
484	ethyl-2-bromoiosbutyrate	0.1523	View
485	1,1-dichloroacetone	0.6409	View
486	3-chloro-2-butanone	0.2690	View
487	1-bromo-3,3-dimethyl-2-butanone	2.3768	View
488	3-chloro-2,4-pentanedione	1.4437	View
489	1,4-dibromo-2,3-butanedione	1.7620	View
490	2,4-dibromo-2,4-dimethyl-3-pentanone	0.5130	View
491	2,5-dibromo-3,4-hexanedione	2.1675	View
492	1,4-dibromo-2-butene	1.9245	View
493	2-chloropropionitrile	-0.8631	View
494	chloroacetonitrile	0.8453	View
495	dichloroacetonitrile	0.9731	View
496	2-bromopropionitrile	0.6256	View
497	1,3-dichloroacetone	2.0458	View
498	Trichloroacetonitrile	1.8827	View
499	Bromoacetonitrile	2.2291	View
500	Dibromoacetonitrile	2.3979	View

Bibliography

Schultz, T. W.; Cronin, M. T. D.; Netzeva, T. I.; Aptula, A. O. Structure-Toxicity Relationships for Aliphatic Chemicals Evaluated with Tetrahymena pyriformis. Chem. Res. Toxicol. 2002, 15, 1602–1609. https://doi.org/10.1021/tx025589p
Schultz, T. W. TETRATOX: Tetrahymena pyriformis population growth impairment endpoint - a surrogate for fish lethality. Toxicol. Mech. Meth. 1997, 7, 289–309. https://doi.org/10.1080/105172397243079

10967/11 - QDB Compounds

QsarDB Repository

Schultz, T.W.; Cronin, M.T.D.; Netzeva, T.I.; Aptula, A.O. Structure-Toxicity Relationships for Aliphatic Chemicals Evaluated with Tetrahymena pyriformis. Chem. Res. Toxicol. 2002, 15, 12, 1602–1609.

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