SB-436811
SMILES | CN(CCCOc1ccc(cc1)CN1CC[C@@H](C1)NC(=O)c1ccc(c(c1)Cl)Cl)C |
InChIKey | AMSSIFVGNFEEFU-IBGZPJMESA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 1 |
Rotatable bonds | 9 |
Molecular weight (Da) | 449.2 |
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 |
UT | UR2R | Rat | Urotensin | A | pKi | 6.7 | 6.7 | 6.7 | Guide to Pharmacology |
UT | UR2R | Rhesus macaque | Urotensin | A | pKi | 6.6 | 6.6 | 6.6 | ChEMBL |
UT | UR2R | Rat | Urotensin | A | pKi | 5.5 | 7.0 | 8.49 | ChEMBL |
UT | UR2R | Human | Urotensin | A | pKi | 6.6 | 6.68 | 6.7 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
UT | UR2R | Human | Urotensin | A | pIC50 | 6.77 | 6.79 | 6.8 | ChEMBL |