compound 42 [PMID: 22545772]
compound 42 [PMID: 22545772]
| SMILES | CC(C)c1nc(N2CCN(c3ncc(OCc4ccncc4C#N)cn3)[C@@H](C)C2)no1 |
| InChIKey | UNGZTVLHLKAKQE-HNNXBMFYSA-N |
Chemical Properties
| Hydrogen bond acceptors | 10 |
| Hydrogen bond donors | 0 |
| Rotatable bonds | 6 |
| Molecular weight (Da) | 420.2 |
Database connections
No bioactivity data available.
compound 42 [PMID: 22545772]
Drug properties
| Molecular type | Small molecule |
| Physiological/Surrogate | Surrogate |
| Approved drug | No |
Distribution across phases (no. indications)
Phase I
Phase II
Phase III
Phase IV