General Information of the Compound
| Compound ID |
CP0404888
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| Compound Name |
N-[3-chloro-4-(4-ethylpiperazin-1-yl)phenyl]-2-phenylmethoxyacetamide
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| Structure |
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| Formula |
C21H26ClN3O2
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| Molecular Weight |
387.911
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| Canonical SMILES |
CCN1CCN(CC1)c1ccc(NC(=O)COCc2ccccc2)cc1Cl
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| InChI |
InChI=1S/C21H26ClN3O2/c1-2-24-10-12-25(13-11-24)20-9-8-18(14-19(20)22)23-21(26)16-27-15-17-6-4-3-5-7-17/h3-9,14H,2,10-13,15-16H2,1H3,(H,23,26)
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| InChIKey |
SOYBOJZGAPAEEA-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