General Information of the Compound
| Compound ID |
CP0501485
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| Compound Name |
2-(2,4-Dichloro-phenoxy)-N-[4-methyl-2-(4-methyl-piperazin-1-yl)-quinolin-6-yl]-propionamide
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| Structure |
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| Formula |
C24H26Cl2N4O2
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| Molecular Weight |
473.404
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| Canonical SMILES |
CC(Oc1ccc(Cl)cc1Cl)C(=O)Nc1ccc2nc(cc(C)c2c1)N1CCN(C)CC1
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| InChI |
InChI=1S/C24H26Cl2N4O2/c1-15-12-23(30-10-8-29(3)9-11-30)28-21-6-5-18(14-19(15)21)27-24(31)16(2)32-22-7-4-17(25)13-20(22)26/h4-7,12-14,16H,8-11H2,1-3H3,(H,27,31)
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| InChIKey |
YVDKIOCGSQYBND-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