General Information of the Compound
| Compound ID |
CP0527677
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| Compound Name |
2,6-dimethyl-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 |
C26H29N3O3S
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| Molecular Weight |
463.603
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| Canonical SMILES |
CC1CC(=O)c2c(ccc(C)c2N2CCN(C)CC2)N1S(=O)(=O)c1ccc2ccccc2c1
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| InChI |
InChI=1S/C26H29N3O3S/c1-18-8-11-23-25(26(18)28-14-12-27(3)13-15-28)24(30)16-19(2)29(23)33(31,32)22-10-9-20-6-4-5-7-21(20)17-22/h4-11,17,19H,12-16H2,1-3H3
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| InChIKey |
YCFBZCBUEYCCEX-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