CHEMBL1390139


SMILES O=[N+]([O-])c1cc(S(=O)(=O)C(F)(F)F)ccc1Sc1nc2ccccc2[nH]1
InChIKey CNXPXYYJQNDCLC-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 1
Rotatable bonds 4
Molecular weight (Da) 403.0

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
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
S1P4 S1PR4 Human Lysophospholipid (S1P) A pIC50 5.89 6.0 6.11 ChEMBL
S1P1 S1PR1 Human Lysophospholipid (S1P) A pIC50 4.46 4.46 4.46 ChEMBL
MC4 MC4R Human Melanocortin A pIC50 5.12 5.12 5.12 ChEMBL
NPS NPSR1 Human Neuropeptide S A Potency 4.9 4.9 4.9 ChEMBL