palosuran
SMILES | O=C(Nc1cc(C)nc2c1cccc2)NCCN1CCC(CC1)(O)Cc1ccccc1 |
InChIKey | WYJCYXOCHXWTHG-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 3 |
Rotatable bonds | 6 |
Molecular weight (Da) | 418.2 |
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 | Rhesus macaque | Urotensin | A | pKi | 8.4 | 8.4 | 8.4 | ChEMBL |
UT | UR2R | Human | Urotensin | A | pKi | 7.39 | 7.85 | 8.3 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
UT | UR2R | Human | Urotensin | A | pIC50 | 7.1 | 7.1 | 7.1 | Guide to Pharmacology |
UT | UR2R | Human | Urotensin | A | pIC50 | 6.5 | 7.45 | 8.44 | ChEMBL |
UT | UR2R | Rat | Urotensin | A | pIC50 | 7.77 | 7.77 | 7.77 | ChEMBL |