Molecule Details
| InChIKey | NELAJQKSVYVYHT-IYBDPMFKSA-N |
|---|---|
| Compound Name | N-[5-[(3S,5R)-3,5-dimethylpiperazin-1-yl]-2-pyridinyl]-3-propan-2-yl-2,5,11,13-tetrazatricyclo[7.4.0.02,6]trideca-1(13),3,5,7,9,11-hexaen-12-amine |
| Canonical SMILES | CC(C)c1cnc2ccc3cnc(Nc4ccc(N5C[C@@H](C)N[C@@H](C)C5)cn4)nc3n12 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 3 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 8.12 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile