SKF 105854


SMILES CN1CCc2c3c(C1)c(Br)oc3ccc2Cl
InChIKey NYGANYRUZQPPGP-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 2
Hydrogen bond donors 0
Rotatable bonds 0
Molecular weight (Da) 299.0

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
ETA EDNRA Human Endothelin A pKi 10.47 10.47 10.47 Guide to Pharmacology
ETB EDNRB Human Endothelin A pKi 6.86 6.86 6.86 Guide to Pharmacology
ETA EDNRA Human Endothelin A pKi 10.47 10.47 10.47 ChEMBL
ETA EDNRA Rat Endothelin A pKi 10.33 10.4 10.47 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
ETA EDNRA Human Endothelin A pA2 9.2 9.2 9.2 Guide to Pharmacology
ETA EDNRA Human Endothelin A pIC50 9.51 10.16 10.47 ChEMBL
ETB EDNRB Human Endothelin A pIC50 6.29 6.85 7.2 ChEMBL
ETA EDNRA Rat Endothelin A pIC50 8.82 9.46 10.1 ChEMBL
ETB EDNRB Pig Endothelin A pIC50 6.28 6.65 6.96 ChEMBL