General Information of the Compound
| Compound ID |
CP0902436
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| Compound Name |
N-[3-Dimethylamino-1-(2-naphthyl)propyl]-4-(4-chlorophenyl)benzamide HCl
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| Structure |
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| Formula |
C28H28Cl2N2O
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| Molecular Weight |
479.451
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| Canonical SMILES |
CN(C)CCC(NC(=O)c1ccc(-c2ccc(Cl)cc2)cc1)c1ccc2ccccc2c1.Cl
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| InChI |
InChI=1S/C28H27ClN2O.ClH/c1-31(2)18-17-27(25-12-9-20-5-3-4-6-24(20)19-25)30-28(32)23-10-7-21(8-11-23)22-13-15-26(29)16-14-22;/h3-16,19,27H,17-18H2,1-2H3,(H,30,32);1H
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| InChIKey |
HLNQSFAFOOOOLK-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