General Information of the Compound
| Compound ID |
CP0484214
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| Compound Name |
propyl 4-[4-chloro-2-(4-methoxyphenyl)quinoline-7-carbonyl]piperazine-1-carboxylate
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| Structure |
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| Formula |
C25H26ClN3O4
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| Molecular Weight |
467.953
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| Canonical SMILES |
CCCOC(=O)N1CCN(CC1)C(=O)c1ccc2c(Cl)cc(nc2c1)-c1ccc(OC)cc1
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| InChI |
InChI=1S/C25H26ClN3O4/c1-3-14-33-25(31)29-12-10-28(11-13-29)24(30)18-6-9-20-21(26)16-22(27-23(20)15-18)17-4-7-19(32-2)8-5-17/h4-9,15-16H,3,10-14H2,1-2H3
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| InChIKey |
KMTDGXDHTKJSQN-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