CHEMBL1344225


SMILES COc1ccc(NC(=O)/C(Cl)=C(/Cl)[S+]([O-])Cc2ccc(C)cc2)cn1
InChIKey UKBGNIASULYWLD-FOCLMDBBSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 6
Molecular weight (Da) 398.0

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
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
S1P4 S1PR4 Human Lysophospholipid (S1P) A pIC50 6.4 6.4 6.4 ChEMBL
S1P2 S1PR2 Human Lysophospholipid (S1P) A pIC50 6.01 6.06 6.12 ChEMBL
M1 ACM1 Rat Acetylcholine (muscarinic) A Potency 5.0 5.0 5.0 ChEMBL
AT1 AGTR1 Human Angiotensin A pIC50 5.65 5.65 5.65 ChEMBL
κ OPRK Human Opioid A pIC50 5.33 5.38 5.42 ChEMBL
NPS NPSR1 Human Neuropeptide S A Potency 5.65 5.77 6.0 ChEMBL
S1P1 S1PR1 Human Lysophospholipid (S1P) A pIC50 5.35 5.35 5.35 ChEMBL