General Information of the Compound
| Compound ID |
CP0332578
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| Compound Name |
N-(3,4-dichlorophenyl)-4-(piperidin-3-ylmethyl)piperazine-1-carboxamide
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| Structure |
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| Formula |
C17H24Cl2N4O
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| Molecular Weight |
371.312
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| Canonical SMILES |
Clc1ccc(NC(=O)N2CCN(CC3CCCNC3)CC2)cc1Cl
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| InChI |
InChI=1S/C17H24Cl2N4O/c18-15-4-3-14(10-16(15)19)21-17(24)23-8-6-22(7-9-23)12-13-2-1-5-20-11-13/h3-4,10,13,20H,1-2,5-9,11-12H2,(H,21,24)
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| InChIKey |
GQDSQCQJLXEXKL-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