General Information of the Compound
| Compound ID |
CP0500873
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| Compound Name |
N-(4-chlorophenyl)-4-[4-(2-chlorophenyl)piperazin-1-yl]butanamide
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| Structure |
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| Formula |
C20H23Cl2N3O
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| Molecular Weight |
392.33
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| Canonical SMILES |
Clc1ccc(NC(=O)CCCN2CCN(CC2)c2ccccc2Cl)cc1
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| InChI |
InChI=1S/C20H23Cl2N3O/c21-16-7-9-17(10-8-16)23-20(26)6-3-11-24-12-14-25(15-13-24)19-5-2-1-4-18(19)22/h1-2,4-5,7-10H,3,6,11-15H2,(H,23,26)
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| InChIKey |
BERGKJMYSFCRGS-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