General Information of the Compound
| Compound ID |
CP0464196
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| Compound Name |
N-[2-(1-benzyl-3,4-dihydro-2H-quinolin-2-yl)ethyl]propanamide
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| Structure |
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| Formula |
C21H26N2O
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| Molecular Weight |
322.452
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| Canonical SMILES |
CCC(=O)NCCC1CCc2ccccc2N1Cc1ccccc1
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| InChI |
InChI=1S/C21H26N2O/c1-2-21(24)22-15-14-19-13-12-18-10-6-7-11-20(18)23(19)16-17-8-4-3-5-9-17/h3-11,19H,2,12-16H2,1H3,(H,22,24)
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| InChIKey |
NKEWYMMHKCYAOC-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