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: | 4376-18-5 | |
|---|---|---|
| Name: | Monomethyl phthalate | |
| Description: | ||
| Labels: | training | |
| CAS: | 4376-18-5 | |
| InChi Code: | InChI=1S/C9H8O4/c1-13-9(12)7-5-3-2-4-6(7)8(10)11/h2-5H,1H3,(H,10,11) |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.017615554 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |