CHEMBL4462793
SMILES | Clc1ccc(Cc2nnc(CCc3c[nH]c4ccccc34)n2CCCc2c[nH]cn2)cc1Cl |
InChIKey | MYPLDJKSSOVSCI-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 2 |
Rotatable bonds | 9 |
Molecular weight (Da) | 478.1 |
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 | 5.32 | 5.32 | 5.32 | ChEMBL |
SST4 | SSR4 | Human | Somatostatin | A | pKi | 7.72 | 7.72 | 7.72 | ChEMBL |
SST3 | SSR3 | Human | Somatostatin | A | pKi | 5.18 | 5.18 | 5.18 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
SST4 | SSR4 | Human | Somatostatin | A | pEC50 | 8.17 | 8.17 | 8.17 | ChEMBL |