General Information of the Compound
| Compound ID |
CP0036968
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| Compound Name |
4-(2-(1-isopropyl-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 |
C25H31N7O2
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| Molecular Weight |
461.57
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| Canonical SMILES |
CC(C)n1cnc(CCNc2cc[nH]c(=O)c2-c2nc3c(C)cc(cc3[nH]2)N2CCOCC2)c1
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| InChI |
InChI=1S/C25H31N7O2/c1-16(2)32-14-18(28-15-32)4-6-26-20-5-7-27-25(33)22(20)24-29-21-13-19(12-17(3)23(21)30-24)31-8-10-34-11-9-31/h5,7,12-16H,4,6,8-11H2,1-3H3,(H,29,30)(H2,26,27,33)
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| InChIKey |
UGNWYKNPWHBPKN-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