General Information of the Compound
| Compound ID |
CP0445539
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| Compound Name |
(E)-N-[2-[2-(dimethylamino)ethyl-methylamino]-4-methylquinolin-6-yl]-3-(4-methylphenyl)prop-2-enamide
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| Structure |
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| Formula |
C25H30N4O
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| Molecular Weight |
402.542
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| Canonical SMILES |
CN(C)CCN(C)c1cc(C)c2cc(NC(=O)\C=C\c3ccc(C)cc3)ccc2n1
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| InChI |
InChI=1S/C25H30N4O/c1-18-6-8-20(9-7-18)10-13-25(30)26-21-11-12-23-22(17-21)19(2)16-24(27-23)29(5)15-14-28(3)4/h6-13,16-17H,14-15H2,1-5H3,(H,26,30)/b13-10+
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| InChIKey |
ACSLJTYYCFGVHX-JLHYYAGUSA-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