General Information of the Compound
| Compound ID |
CP0373495
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| Compound Name |
4-(4-benzylpiperazin-1-yl)-N-(4-chlorophenyl)butanamide
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| Structure |
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| Formula |
C21H26ClN3O
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| Molecular Weight |
371.912
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| Canonical SMILES |
Clc1ccc(NC(=O)CCCN2CCN(Cc3ccccc3)CC2)cc1
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| InChI |
InChI=1S/C21H26ClN3O/c22-19-8-10-20(11-9-19)23-21(26)7-4-12-24-13-15-25(16-14-24)17-18-5-2-1-3-6-18/h1-3,5-6,8-11H,4,7,12-17H2,(H,23,26)
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| InChIKey |
PQACGVZVBISRFG-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