CHEMBL2112223
SMILES | NCCCCCNC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)N1CCC2(C=Cc3ccccc32)CC1 |
InChIKey | CIZDAUBRPMKZKS-HHHXNRCGSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 4 |
Rotatable bonds | 9 |
Molecular weight (Da) | 499.3 |
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 |
SST1 | SSR1 | Human | Somatostatin | A | pKi | 5.27 | 5.27 | 5.27 | ChEMBL |
SST4 | SSR4 | Human | Somatostatin | A | pKi | 5.17 | 5.17 | 5.17 | ChEMBL |
SST2 | SSR2 | Human | Somatostatin | A | pKi | 7.34 | 7.34 | 7.34 | ChEMBL |
SST3 | SSR3 | Human | Somatostatin | A | pKi | 5.59 | 5.59 | 5.59 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |