CHEMBL1800082 [126215]
CHEMBL1800082
| SMILES | Cc1cc(-c2cc(C(=O)NC3C4(C)CCC(C4)C3(C)C)nn2Cc2ccc(CNCCCCCCN)cc2)ccc1Cl |
| InChIKey | RPGHSWDZIOSBOB-UHFFFAOYSA-N |
Chemical Properties
| Hydrogen bond acceptors | 5 |
| Hydrogen bond donors | 3 |
| Rotatable bonds | 13 |
| Log P | 7.114 |
| Molecular weight (Da) | 589.4 |
| Stereochemistry info | unspecified |
Database connections
Bioactivities
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| Protein | Gene | Species | Family | Class | Type | Min | Avg | Max | Database |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| Protein | Gene | Species | Family | Class | Type | Min | Avg | Max | Database |
CHEMBL1800082
Drug properties
| Molecular type | Small molecule |
| Physiological/Surrogate | Surrogate |
| Approved drug | No |
Distribution across phases (no. indications)
Phase I
0
Phase II
0
Phase III
0
Phase IV
0