CHEMBL5175637
SMILES | Fc1ccc2c(Cc3nnc(Cc4c[nH]c5cc(F)ccc45)n3CCCc3c[nH]cn3)c[nH]c2c1 |
InChIKey | VGAIZXCXOWVPIB-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 3 |
Rotatable bonds | 8 |
Molecular weight (Da) | 471.2 |
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 |
SST2 | SSR2 | Human | Somatostatin | A | pKi | 6.19 | 6.19 | 6.19 | ChEMBL |
SST3 | SSR3 | Human | Somatostatin | A | pKi | 5.76 | 5.76 | 5.76 | ChEMBL |
SST1 | SSR1 | Human | Somatostatin | A | pKi | 7.01 | 7.01 | 7.01 | ChEMBL |
SST4 | SSR4 | Human | Somatostatin | A | pKi | 9.15 | 9.15 | 9.15 | ChEMBL |
SST5 | SSR5 | Human | Somatostatin | A | pKi | 5.03 | 5.03 | 5.03 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
SST4 | SSR4 | Human | Somatostatin | A | pEC50 | 9.15 | 9.15 | 9.15 | ChEMBL |