General Information of the Compound
| Compound ID |
CP0461112
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| Compound Name |
3,5-dichloro-2-hydroxy-6-methoxy-N-[2-(4-phenylpiperazin-1-yl)ethyl]benzamide
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| Structure |
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| Formula |
C20H23Cl2N3O3
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| Molecular Weight |
424.328
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| Canonical SMILES |
COc1c(Cl)cc(Cl)c(O)c1C(=O)NCCN1CCN(CC1)c1ccccc1
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| InChI |
InChI=1S/C20H23Cl2N3O3/c1-28-19-16(22)13-15(21)18(26)17(19)20(27)23-7-8-24-9-11-25(12-10-24)14-5-3-2-4-6-14/h2-6,13,26H,7-12H2,1H3,(H,23,27)
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| InChIKey |
KEPCRQPBSHAPNH-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