W146


SMILES CCCCCCc1cccc(c1)NC(=O)[C@@H](CCP(=O)(O)O)N
InChIKey FWJRVGZWNDOOFH-OAHLLOKOSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 4
Rotatable bonds 10
Molecular weight (Da) 342.2

Drug properties

Molecular type Small molecule
Endogenous/Surrogate Surrogate
Approved drug No

Database connections

Structure pdb 3V2W 3V2Y

Bioactivity

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
S1P1 S1PR1 Human Lysophospholipid (S1P) A pKi 7.11 7.11 7.11 Guide to Pharmacology
S1P1 S1PR1 Human Lysophospholipid (S1P) A pKi 5.33 6.82 7.75 ChEMBL