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BDBM27108 2-[(2R)-1-(propan-2-yl)pyrrolidin-2-yl]-1H-1,3-benzodiazole-4-carboxamide::cyclic amine-containing benzimidazole carboxamide, 5b

SMILES: CC(C)N1CCC[C@@H]1c1nc2cccc(C(N)=O)c2[nH]1

InChI Key: InChIKey=AACMGYWBWGBZPF-GFCCVEGCSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 27108   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Poly [ADP-ribose] polymerase 1


(Homo sapiens (Human))
BDBM27108
PNG
(2-[(2R)-1-(propan-2-yl)pyrrolidin-2-yl]-1H-1,3-ben...)
Show SMILES CC(C)N1CCC[C@@H]1c1nc2cccc(C(N)=O)c2[nH]1
Show InChI InChI=1S/C15H20N4O/c1-9(2)19-8-4-7-12(19)15-17-11-6-3-5-10(14(16)20)13(11)18-15/h3,5-6,9,12H,4,7-8H2,1-2H3,(H2,16,20)(H,17,18)/t12-/m1/s1
PDB
MMDB

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Similars

Article
PubMed
21 -10.4n/an/an/an/an/a8.022



Abbott Laboratories



Assay Description
PARP assays utilizing SPA bead-based detection were carried out in 96-well plates. After reaction was terminated, the reaction mixtures were transfer...


Bioorg Med Chem 16: 6965-75 (2008)


Article DOI: 10.1016/j.bmc.2008.05.044
BindingDB Entry DOI: 10.7270/Q2JD4V3X
More data for this
Ligand-Target Pair