General Information of the Compound
| Compound ID |
CP0552974
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| Compound Name |
3-(3,4-dihydro-2H-quinolin-1-yl)-1-(3-methylpiperidin-1-yl)propan-1-one
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| Structure |
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| Formula |
C18H26N2O
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| Molecular Weight |
286.419
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| Canonical SMILES |
CC1CCCN(C1)C(=O)CCN1CCCc2ccccc12
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| InChI |
InChI=1S/C18H26N2O/c1-15-6-4-12-20(14-15)18(21)10-13-19-11-5-8-16-7-2-3-9-17(16)19/h2-3,7,9,15H,4-6,8,10-14H2,1H3
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| InChIKey |
CCQBBHNLKQFRRR-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