General Information of the Compound
| Compound ID |
CP0279399
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| Compound Name |
4-(2-(5-chloro-1-(2-methoxyethyl)-1H-imidazol-4-yl)ethylamino)-3-(4-methyl-6-morpholino-1H-benzo[d]imidazol-2-yl)pyridin-2(1H)-one
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| Structure |
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| Formula |
C25H30ClN7O3
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| Molecular Weight |
512.014
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| Canonical SMILES |
COCCn1cnc(CCNc2cc[nH]c(=O)c2-c2nc3c(C)cc(cc3[nH]2)N2CCOCC2)c1Cl
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| InChI |
InChI=1S/C25H30ClN7O3/c1-16-13-17(32-8-11-36-12-9-32)14-20-22(16)31-24(30-20)21-18(3-6-28-25(21)34)27-5-4-19-23(26)33(15-29-19)7-10-35-2/h3,6,13-15H,4-5,7-12H2,1-2H3,(H,30,31)(H2,27,28,34)
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| InChIKey |
FEPRJDAIWVLTCT-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