General Information of the Compound
| Compound ID |
CP0413686
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| Compound Name |
N-[(1-benzyl-3,4-dihydro-2H-quinolin-2-yl)methyl]cyclobutanecarboxamide
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| Structure |
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| Formula |
C22H26N2O
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| Molecular Weight |
334.463
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| Canonical SMILES |
O=C(NCC1CCc2ccccc2N1Cc1ccccc1)C1CCC1
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| InChI |
InChI=1S/C22H26N2O/c25-22(19-10-6-11-19)23-15-20-14-13-18-9-4-5-12-21(18)24(20)16-17-7-2-1-3-8-17/h1-5,7-9,12,19-20H,6,10-11,13-16H2,(H,23,25)
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| InChIKey |
BUSSQDIMFNHHOV-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