General Information of the Compound
| Compound ID |
CP0434172
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| Compound Name |
(4-chlorophenyl)-[4-[2-(4-methoxyphenoxy)ethyl]piperazin-1-yl]methanone
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| Structure |
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| Formula |
C20H23ClN2O3
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| Molecular Weight |
374.868
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| Canonical SMILES |
COc1ccc(OCCN2CCN(CC2)C(=O)c2ccc(Cl)cc2)cc1
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| InChI |
InChI=1S/C20H23ClN2O3/c1-25-18-6-8-19(9-7-18)26-15-14-22-10-12-23(13-11-22)20(24)16-2-4-17(21)5-3-16/h2-9H,10-15H2,1H3
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| InChIKey |
CRQSMHIXGLLMKT-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