General Information of the Compound
| Compound ID |
CP0256834
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| Compound Name |
4-(2-(5-bromo-1-ethyl-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 |
C24H28BrN7O2
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| Molecular Weight |
526.439
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| Canonical SMILES |
CCn1cnc(CCNc2cc[nH]c(=O)c2-c2nc3c(C)cc(cc3[nH]2)N2CCOCC2)c1Br
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| InChI |
InChI=1S/C24H28BrN7O2/c1-3-31-14-28-18(22(31)25)5-6-26-17-4-7-27-24(33)20(17)23-29-19-13-16(12-15(2)21(19)30-23)32-8-10-34-11-9-32/h4,7,12-14H,3,5-6,8-11H2,1-2H3,(H,29,30)(H2,26,27,33)
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| InChIKey |
SHPXQHPAJZUZSQ-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