General Information of the Compound
| Compound ID |
CP0549296
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| Compound Name |
(2-chlorophenyl)-(4-methyl-3-phenylpiperazin-1-yl)methanone
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| Structure |
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| Formula |
C18H19ClN2O
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| Molecular Weight |
314.816
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| Canonical SMILES |
CN1CCN(CC1c1ccccc1)C(=O)c1ccccc1Cl
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| InChI |
InChI=1S/C18H19ClN2O/c1-20-11-12-21(13-17(20)14-7-3-2-4-8-14)18(22)15-9-5-6-10-16(15)19/h2-10,17H,11-13H2,1H3
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| InChIKey |
ORNAFSLOXVSFBM-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