General Information of the Compound
| Compound ID |
CP0917286
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| Compound Name |
N-[3-Dimethylamino-1-(4-methylphenyl)propyl]-3-(4-chlorophenyl)benzamide HCl
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| Structure |
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| Formula |
C25H28Cl2N2O
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| Molecular Weight |
443.418
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| Canonical SMILES |
Cc1ccc(C(CCN(C)C)NC(=O)c2cccc(-c3ccc(Cl)cc3)c2)cc1.Cl
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| InChI |
InChI=1S/C25H27ClN2O.ClH/c1-18-7-9-20(10-8-18)24(15-16-28(2)3)27-25(29)22-6-4-5-21(17-22)19-11-13-23(26)14-12-19;/h4-14,17,24H,15-16H2,1-3H3,(H,27,29);1H
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| InChIKey |
WJRCTNVPRCEPON-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