Molecule Details
| InChIKey | NZMRWXAWWPBYLR-UHFFFAOYSA-N |
|---|---|
| Compound Name | 3-{[9-Isopropyl-6-(4-methoxy-benzylamino)-9H-purin-2-yl]-pyridin-3-ylmethyl-amino}-2-methyl-propionitrile |
| Canonical SMILES | COc1ccc(CNc2nc(N(Cc3cccnc3)CC(C)C#N)nc3c2ncn3C(C)C)cc1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 3 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 6.0 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile