General Information of the Compound
| Compound ID |
CP0133153
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| Compound Name |
3-(6-(1H-imidazol-1-yl)-4-methyl-1H-benzo[d]imidazol-2-yl)-4-(2-(3-chloro-4-methoxyphenyl)-2-hydroxyethylamino)pyridin-2(1H)-one
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| Structure |
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| Formula |
C25H23ClN6O3
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| Molecular Weight |
490.951
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| Canonical SMILES |
COc1ccc(cc1Cl)C(O)CNc1cc[nH]c(=O)c1-c1nc2cc(cc(C)c2[nH]1)-n1ccnc1
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| InChI |
InChI=1S/C25H23ClN6O3/c1-14-9-16(32-8-7-27-13-32)11-19-23(14)31-24(30-19)22-18(5-6-28-25(22)34)29-12-20(33)15-3-4-21(35-2)17(26)10-15/h3-11,13,20,33H,12H2,1-2H3,(H,30,31)(H2,28,29,34)
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| InChIKey |
ZFWLXTPDKRBCNN-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