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: | 55779-06-1 | |
|---|---|---|
| Name: | Astromicin | |
| Description: | ||
| Labels: | eval | |
| CAS: | 55779-06-1 | |
| InChi Code: | InChI=1S/C17H35N5O6/c1-7(19)9-5-4-8(20)17(27-9)28-15-11(21)13(24)16(26-3)12(14(15)25)22(2)10(23)6-18/h7-9,11-17,24-25H,4-6,18-21H2,1-3H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.015658953 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |