CHEMBL4588454
SMILES | CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CC(=O)O)C(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CCC[C@H]1C(=O)NCC(=O)O |
InChIKey | LHGCUVPUBNGERS-FVSPLASQSA-N |
Chemical properties
Hydrogen bond acceptors | 13 |
Hydrogen bond donors | 14 |
Rotatable bonds | 27 |
Molecular weight (Da) | 955.5 |
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 | 6.8 | 7.25 | 7.7 | ChEMBL |
AT1 | AGTR1 | Human | Angiotensin | A | pEC50 | 6.18 | 6.22 | 6.26 | ChEMBL |