Home
Drugs
Targets
Pathways
Ontologies
Cyp450s
Adv.search
Help/FAQ

Drug Details

add
Name:CHEMBL1170850
PubChem ID:46839192
Pathway:Show KEGG pathways
InChI:InChI=1S/C25H28N8O8/c1-11-14-7-40-25(37)16(14)18(34)13(21(11)38-2)3-4-32-5-12(30-31-32)6-39-8-15-19(35)20(36)24(41-15)33-10-29-17-22(26)27-9-28-23(17)33/h5,9-10,15,19-20,24,34-36H,3-4,6-8H2,1-2H3,(H2,26,27,28)/t15-,19-,20-,24-/m1/s1
SMILES:COc1c(CCn2nnc(c2)COC[C@H]2O[C@H]([C@@H]([C@@H]2O)O)n2cnc3c2ncnc3N)c(O)c2c(c1C)COC2=O

Properties:
Formula:C25H28N8O8Atoms:41
Molecular Weight:568.539Rotatable Bonds:9
H-bond Acceptors:16H-bond Donors:4
logP:0.3529
Targets:
Synonyms:
6-(2-(4-(Adenosin-5'-yl)methyl-1H-1,2,3-triazol-1-yl)ethyl)-7-
CHEBI:749512
CHEMBL1170850
hydroxy-5-methoxy-4-methylisobenzofuran-1(3H)-one