CHEMBL4483576
SMILES | CNCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)c(F)c1)C(=O)N[C@H](C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)O)[C@@H](C)OC)C(C)C |
InChIKey | BNXBLRYANBYHGI-ZLNBOQQZSA-N |
Chemical properties
Hydrogen bond acceptors | 13 |
Hydrogen bond donors | 13 |
Rotatable bonds | 26 |
Molecular weight (Da) | 945.5 |
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 |
AT1 | AGTRA | Rat | Angiotensin | A | pEC50 | 8.3 | 8.3 | 8.3 | ChEMBL |
AT1 | AGTR1 | Human | Angiotensin | A | pEC50 | 8.0 | 8.0 | 8.0 | ChEMBL |