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Ligand · 12C

12C · 4-[(3S)-1-azabicyclo[2.2.2]oct-3-ylamino]-3-(1H-benzimidazol-2-yl)-6-chloroquinolin-2(1H)-one

12C, 4-[(3S)-1-azabicyclo[2.2.2]oct-3-ylamino]-3-(1H-benzimidazol-2-yl)-6-chloroquinolin-2(1H)-one (C23 H22 Cl N5 O, 419.9 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every binding site with its residues…

Component
12C
Formula
C23 H22 Cl N5 O
Class
ligand
Structures
1
PDB entries
1

Binding sites

12C in 1 structure; the first of them:

  • 2GDO · 4-(Aminoalkylamino)-3-Benzimidazole-Quinoli s As Potent CHK1 Inhibitors · 12C A298 · binds LEU15, GLY16, GLU17, GLY18, VAL23, ALA36, LYS38, VAL68 and 11 more

Residues it binds most

GLU 1, GLY 1, LEU 1, SER 1, VAL 1, ALA 1, ASP 1, CYS 1, LYS 1, TYR 1 (residue and the binding sites it lines).

Found with

  • SO4 · Sulfate ion

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