General Information of the Compound
| Compound ID |
CP0946939
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| Compound Name |
2,4-Dimethyl-N-(1,2,3,4-tetrahydro-1-isoquinolinylmethyl)benzamide
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| Structure |
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| Formula |
C19H22N2O
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| Molecular Weight |
294.398
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| Canonical SMILES |
Cc1ccc(C(=O)NCC2NCCc3ccccc32)c(C)c1
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| InChI |
InChI=1S/C19H22N2O/c1-13-7-8-16(14(2)11-13)19(22)21-12-18-17-6-4-3-5-15(17)9-10-20-18/h3-8,11,18,20H,9-10,12H2,1-2H3,(H,21,22)
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| InChIKey |
KBTOFMSZECVTGS-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