Garcia-Sosa, A. T.; Maran, U. Using combined docking, chemical fingerprints, and Bayesian classifiers for the androgen receptor binding activity of the CoMPARA data. Toxicological Sciences 2020.
Compound
| ID: | 375-85-9 | |
|---|---|---|
| Name: | Perfluoroheptanoic acid | |
| Description: | ||
| Labels: | training | |
| CAS: | 375-85-9 | |
| InChi Code: | InChI=1S/C7HF13O2/c8-2(9,1(21)22)3(10,11)4(12,13)5(14,15)6(16,17)7(18,19)20/h(H,21,22) |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.009414576 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |