CHEMBL371758


SMILES C[C@@](N)(CCc1ccc(OCCCCCCCCCCCNc2ccc([N+](=O)[O-])c3nonc23)cc1)COP(=O)(O)O
InChIKey KPWIKEPVWRXDHZ-MUUNZHRXSA-N

Chemical properties

Hydrogen bond acceptors 10
Hydrogen bond donors 4
Rotatable bonds 21
Molecular weight (Da) 607.3

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
S1P5 S1PR5 Human Lysophospholipid (S1P) A pEC50 8.7 8.7 8.7 ChEMBL
S1P3 S1PR3 Human Lysophospholipid (S1P) A pEC50 7.5 7.5 7.5 ChEMBL
S1P1 S1PR1 Human Lysophospholipid (S1P) A pEC50 9.0 9.0 9.0 ChEMBL