General Information of the Compound
| Compound ID |
CP0387089
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| Compound Name |
1-(4-(2,4-dichlorophenyl)piperazin-1-yl)-2-(pyridin-4-ylmethylamino)ethanone
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| Structure |
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| Formula |
C18H20Cl2N4O
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| Molecular Weight |
379.291
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| Canonical SMILES |
Clc1ccc(N2CCN(CC2)C(=O)CNCc2ccncc2)c(Cl)c1
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| InChI |
InChI=1S/C18H20Cl2N4O/c19-15-1-2-17(16(20)11-15)23-7-9-24(10-8-23)18(25)13-22-12-14-3-5-21-6-4-14/h1-6,11,22H,7-10,12-13H2
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| InChIKey |
VEEAVRZUFBNPAA-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