L-365260
SMILES | Cc1cccc(c1)NC(=O)NC1N=C(c2ccccc2)c2c(N(C1=O)C)cccc2 |
InChIKey | KDFQABSFVYLGPM-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 2 |
Rotatable bonds | 3 |
Molecular weight (Da) | 398.2 |
Drug properties
Molecular type | Small molecule |
Endogenous/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 |
GPBA | GPBAR | Human | Bile acid | A | pEC50 | 5.0 | 5.0 | 5.0 | Guide to Pharmacology |
GPBA | GPBAR | Human | Bile acid | A | pEC50 | 4.7 | 4.84 | 4.87 | ChEMBL |
GPBA | GPBAR | Human | Bile acid | A | pIC50 | 5.22 | 5.22 | 5.22 | ChEMBL |
GPBA | GPBAR | Human | Bile acid | A | pEC50 | 8.3 | 8.3 | 8.3 | Drug Central |
GPBA | GPBAR | Mouse | Bile acid | A | pIC50 | 5.28 | 5.28 | 5.28 | ChEMBL |