FR167344
SMILES | O=C(/C=C/c1ccc(cc1)C(=O)N(C)C)NCC(=O)N(c1ccc(c(c1Cl)COc1cccn2c1nc(c2Br)C)Cl)C |
InChIKey | NDOBHDUXUJNXHX-NTEUORMPSA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 1 |
Rotatable bonds | 9 |
Molecular weight (Da) | 671.1 |
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 |
B2 | BKRB2 | Human | Bradykinin | A | pIC50 | 7.2 | 7.2 | 7.2 | Guide to Pharmacology |
B2 | BKRB2 | Human | Bradykinin | A | pIC50 | 8.66 | 8.79 | 8.85 | ChEMBL |
B2 | BKRB2 | Guinea pig | Bradykinin | A | pIC50 | 9.18 | 9.18 | 9.18 | ChEMBL |