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Name:CHEMBL200339
PubChem ID:11527814
Pathway:Show KEGG pathways
InChI:InChI=1S/C32H30ClIN6O3S/c33-32-38-28(36-17-19-8-7-13-22(34)16-19)24-29(39-32)40(18-37-24)31-26(42)25(41)27(44-31)30(43)35-15-14-23(20-9-3-1-4-10-20)21-11-5-2-6-12-21/h1-13,16,18,23,25-27,31,41-42H,14-15,17H2,(H,35,43)(H,36,38,39)/t25-,26+,27-,31+/m0/s1
SMILES:Ic1cccc(c1)CNc1nc(Cl)nc2c1ncn2[C@@H]1S[C@@H]([C@H]([C@H]1O)O)C(=O)NCCC(c1ccccc1)c1ccccc1

Properties:
Formula:C32H30ClIN6O3SAtoms:44
Molecular Weight:741.041Rotatable Bonds:11
H-bond Acceptors:10H-bond Donors:4
logP:5.8345
Targets:
NameUniprot IDSourceReferencesInteraction
Adenosine A3 receptorAA3R_HUMANBindingDB-shows
Synonyms:
CHEBI:435340
CHEMBL200339
CID 11527814
CID11527814