General Information of the Compound
| Compound ID |
CP0168314
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| Compound Name |
4-(2-(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 |
C24H29N7O2
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| Molecular Weight |
447.543
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| Canonical SMILES |
CCn1cnc(CCNc2cc[nH]c(=O)c2-c2nc3c(C)cc(cc3[nH]2)N2CCOCC2)c1
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| InChI |
InChI=1S/C24H29N7O2/c1-3-30-14-17(27-15-30)4-6-25-19-5-7-26-24(32)21(19)23-28-20-13-18(12-16(2)22(20)29-23)31-8-10-33-11-9-31/h5,7,12-15H,3-4,6,8-11H2,1-2H3,(H,28,29)(H2,25,26,32)
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| InChIKey |
XPTGLYUBKGLQML-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