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Drug Details

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Name:CHEMBL293148
PubChem ID:9939145
Pathway:-
InChI:InChI=1S/C32H33N5O9/c1-3-14-37(26-11-6-19-15-25-22(16-21(19)26)30(42)34-17(2)33-25)20-7-4-18(5-8-20)29(41)36-24(32(45)46)9-12-27(38)35-23(31(43)44)10-13-28(39)40/h1,4-5,7-8,15-16,23-24,26H,6,9-14H2,2H3,(H,35,38)(H,36,41)(H,39,40)(H,43,44)(H,45,46)(H,33,34,42)/t23-,24+,26?/m1/s1
SMILES:C#CCN(C1CCc2c1cc1c(=O)nc([nH]c1c2)C)c1ccc(cc1)C(=O)N[C@H](C(=O)O)CCC(=O)N[C@@H](C(=O)O)CCC(=O)O

Properties:
Formula:C32H33N5O9Atoms:46
Molecular Weight:631.633Rotatable Bonds:16
H-bond Acceptors:13H-bond Donors:6
logP:2.5378
Targets:
NameUniprot IDSourceReferencesInteraction
Thymidylate synthaseTYSY_LACCABindingDB-shows
Synonyms:
CHEBI:189029
CHEMBL293148
CID 9939145
CID9939145