TP-680 [8375]
TP-680
| SMILES | O=C(N[C@@H](CSc1ncccc1C(=O)O)C(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1)c1cc2ccccc2[nH]1 |
| InChIKey | JWXZKQOPZVEJHR-PMERELPUSA-N |
Chemical Properties
| Hydrogen bond acceptors | 6 |
| Hydrogen bond donors | 3 |
| Rotatable bonds | 10 |
| Log P | 5.086 |
| Molecular weight (Da) | 619.2 |
| 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 |
TP-680
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