General Information of the Compound
| Compound ID |
CP0543853
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| Compound Name |
7-bromo-5-(4-methylpiperazin-1-yl)-1-(naphthalen-2-ylsulfonyl)-2,3-dihydroquinolin-4(1H)-one
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| Structure |
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| Formula |
C24H24BrN3O3S
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| Molecular Weight |
514.445
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| Canonical SMILES |
CN1CCN(CC1)c1cc(Br)cc2N(CCC(=O)c12)S(=O)(=O)c1ccc2ccccc2c1
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| InChI |
InChI=1S/C24H24BrN3O3S/c1-26-10-12-27(13-11-26)21-15-19(25)16-22-24(21)23(29)8-9-28(22)32(30,31)20-7-6-17-4-2-3-5-18(17)14-20/h2-7,14-16H,8-13H2,1H3
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| InChIKey |
QRHABVZRVLWPOZ-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