CHEMBL33873
SMILES | C/C(=C\c1ccccc1)C(=O)Nc1n[nH]c(C(=O)N[C@@H](CC2CCCCC2)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)n1 |
InChIKey | NVAIYMVSMZKECH-SAYPORNDSA-N |
Chemical properties
Hydrogen bond acceptors | 8 |
Hydrogen bond donors | 8 |
Rotatable bonds | 18 |
Molecular weight (Da) | 727.4 |
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 |
PAR1 | PAR1 | Human | Proteinase-activated | A | pIC50 | 5.38 | 5.38 | 5.38 | ChEMBL |
PAR1 | PAR1 | Human | Proteinase-activated | A | pEC50 | 6.12 | 6.12 | 6.12 | ChEMBL |