General Information of the Compound
| Compound ID |
CP0400059
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| Compound Name |
1-(4-(2,4-dichlorophenyl)piperazin-1-yl)-2-(methyl(pyridin-4-ylmethyl)amino)ethanone
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| Structure |
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| Formula |
C19H22Cl2N4O
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| Molecular Weight |
393.318
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| Canonical SMILES |
CN(CC(=O)N1CCN(CC1)c1ccc(Cl)cc1Cl)Cc1ccncc1
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| InChI |
InChI=1S/C19H22Cl2N4O/c1-23(13-15-4-6-22-7-5-15)14-19(26)25-10-8-24(9-11-25)18-3-2-16(20)12-17(18)21/h2-7,12H,8-11,13-14H2,1H3
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| InChIKey |
KGONGDWVMJGBMU-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