General Information of the Compound
| Compound ID |
CP0546730
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| Compound Name |
3-chloro-N-[2-[4-(2-imidazo[4,5-b]pyridin-3-ylacetyl)piperazin-1-yl]phenyl]benzamide
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| Structure |
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| Formula |
C25H23ClN6O2
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| Molecular Weight |
474.952
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| Canonical SMILES |
Clc1cccc(c1)C(=O)Nc1ccccc1N1CCN(CC1)C(=O)Cn1cnc2cccnc12
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| InChI |
InChI=1S/C25H23ClN6O2/c26-19-6-3-5-18(15-19)25(34)29-20-7-1-2-9-22(20)30-11-13-31(14-12-30)23(33)16-32-17-28-21-8-4-10-27-24(21)32/h1-10,15,17H,11-14,16H2,(H,29,34)
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| InChIKey |
POXNPPFEWKTPBX-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound