purmorphamine
| SMILES | C1CCC(CC1)n1cnc2c1nc(nc2Nc1ccc(cc1)N1CCOCC1)Oc1cccc2c1cccc2 |
| InChIKey | FYBHCRQFSFYWPY-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 8 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 6 |
| Molecular weight (Da) | 520.3 |
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 |
| SMO | SMO | Human | Frizzled | F | pEC50 | 6.0 | 6.0 | 6.0 | Guide to Pharmacology |
| SMO | SMO | Human | Frizzled | F | pIC50 | 5.82 | 5.82 | 5.82 | ChEMBL |
| SMO | SMO | Human | Frizzled | F | pEC50 | 6.0 | 6.0 | 6.0 | ChEMBL |
| SMO | SMO | Mouse | Frizzled | F | pEC50 | 6.1 | 6.1 | 6.1 | ChEMBL |