PSN632408
SMILES | O=C(N1CCC(CC1)OCc1onc(n1)c1ccncc1)OC(C)(C)C |
InChIKey | LHZWKWCEAXQUMX-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 7 |
Hydrogen bond donors | 0 |
Rotatable bonds | 4 |
Molecular weight (Da) | 360.2 |
Drug properties
Molecular type | Small molecule |
Endogenous/Surrogate | Surrogate |
Approved drug | No |
Database connections
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
AT1 | AGTRA | Rat | Angiotensin | A | pKi | 9.64 | 9.64 | 9.64 | ChEMBL |
AT1 | AGTRA | Rat | Angiotensin | A | pKi | 8.02 | 8.02 | 8.02 | Drug Central |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
FFA1 | FFAR1 | Human | Free fatty acid | A | pEC50 | 4.94 | 4.94 | 4.94 | ChEMBL |
FFA1 | FFAR1 | Human | Free fatty acid | A | pEC50 | 8.25 | 8.25 | 8.25 | Drug Central |
FFA1 | FFAR1 | Human | Free fatty acid | A | pEC50 | 5.6 | 5.6 | 5.6 | Guide to Pharmacology |