CHEMBL3799801
SMILES | COc1nc(C)c(Nc2nc(Cl)cn([C@H](COc3cc(C#N)ccn3)C3CC3)c2=O)cc1C |
InChIKey | PLBUBFRSQTYXBK-GOSISDBHSA-N |
Chemical properties
Hydrogen bond acceptors | 9 |
Hydrogen bond donors | 1 |
Rotatable bonds | 8 |
Molecular weight (Da) | 466.2 |
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | No |
Database connections
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
CRF1 | CRFR1 | Rat | Corticotropin-releasing factor | B1 | pIC50 | 8.17 | 8.17 | 8.17 | ChEMBL |