General Information of the Compound
| Compound ID |
CP0243999
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| Compound Name |
5-Chloro-N-[2-(4-ethyl-piperazin-1-yl)-4-methyl-quinolin-6-yl]-2-methoxy-benzamide
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| Structure |
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| Formula |
C24H27ClN4O2
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| Molecular Weight |
438.959
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| Canonical SMILES |
CCN1CCN(CC1)c1cc(C)c2cc(NC(=O)c3cc(Cl)ccc3OC)ccc2n1
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| InChI |
InChI=1S/C24H27ClN4O2/c1-4-28-9-11-29(12-10-28)23-13-16(2)19-15-18(6-7-21(19)27-23)26-24(30)20-14-17(25)5-8-22(20)31-3/h5-8,13-15H,4,9-12H2,1-3H3,(H,26,30)
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| InChIKey |
MDIBEHYTUQHTRX-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