General Information of the Compound
| Compound ID |
CP0490485
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| Compound Name |
5-(4-(3,4-dichlorobenzyl)piperazin-1-yl)-N-(2-chlorophenyl)pentanamide
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| Structure |
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| Formula |
C22H26Cl3N3O
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| Molecular Weight |
454.829
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| Canonical SMILES |
Clc1ccc(CN2CCN(CCCCC(=O)Nc3ccccc3Cl)CC2)cc1Cl
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| InChI |
InChI=1S/C22H26Cl3N3O/c23-18-9-8-17(15-20(18)25)16-28-13-11-27(12-14-28)10-4-3-7-22(29)26-21-6-2-1-5-19(21)24/h1-2,5-6,8-9,15H,3-4,7,10-14,16H2,(H,26,29)
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| InChIKey |
IWYHXBPUSLWDQN-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