CHEMBL3302769


SMILES N=c1ccc2c(-c3ccc(C(=O)NCCCCCCn4cc(CCC#Cc5cccc(CO/N=c6/ccn([C@@H]7O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]7O)c(=O)[nH]6)c5)nn4)cc3C(=O)O)c3ccc(N)c(S(=O)(=O)O)c3oc-2c1S(=O)(=O)O
InChIKey QVVGTRNOIJACOR-WEYCDDFSSA-N

Chemical properties

Hydrogen bond acceptors 23
Hydrogen bond donors 12
Rotatable bonds 23
Molecular weight (Da) 1243.2

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
P2Y6 P2RY6 Human P2Y A pEC50 8.05 8.05 8.05 ChEMBL
P2Y2 P2RY2 Human P2Y A pEC50 5.6 5.6 5.6 ChEMBL