veliparib (CHEBI:62880)

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ChEBI Name	veliparib

ChEBI ID	CHEBI:62880

Definition	A benzimidazole substituted with a carbamoyl group at C-4 and a (2R)-2-methylpyrrolidin-2-yl moiety at C-2. It is a potent, orally bioavailable PARP inhibitor.

Stars	This entity has been manually annotated by the ChEBI Team.

Submitter	Margaret Duesbury

Supplier Information

Download	Molfile XML SDF

Formula

C13H16N4O

Net Charge

Average Mass

244.29230

Monoisotopic Mass

244.13241

InChI

InChI=1S/C13H16N4O/c1-13(6-3-7-15-13)12-16-9-5-2-4-8(11(14)18)10(9)17-12/h2,4-5,15H,3,6-7H2,1H3,(H2,14,18)(H,16,17)/t13-/m1/s1

InChIKey

JNAHVYVRKWKWKQ-CYBMUJFWSA-N

SMILES

C[C@@]1(CCCN1)c1nc2c(cccc2[nH]1)C(N)=O

Roles Classification
Biological Role(s):	EC 2.4.2.30 (NAD(+) ADP-ribosyltransferase) inhibitor An EC 2.4.2.* (pentosyltransferase) inhibitor that interferes with the action of a NAD+ ADP-ribosyltransferase (EC 2.4.2.30).

ChEBI Ontology
Outgoing	veliparib (CHEBI:62880) has role EC 2.4.2.30 (NAD⁺ ADP-ribosyltransferase) inhibitor (CHEBI:62913) veliparib (CHEBI:62880) is a benzimidazoles (CHEBI:22715)

IUPAC Name

2-[(2R)-2-methylpyrrolidin-2-yl]-1H-benzimidazole-4-carboxamide

INN	Source
veliparib	ChemIDplus

Synonyms	Sources
2-[(R)-2-methylpyrrolidin-2-yl]-1H-benzimidazole-4-carboxamide	ChEBI
ABT 888	ChemIDplus
ABT-888	ChemIDplus

Last Modified

24 February 2016