General Information of the Compound
| Compound ID |
CP0851405
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| Compound Name |
N-(1-methyl-2-oxo-1,2,3,4-tetrahydroquinolin-7-yl)-2-(piperidin-1-ylmethyl)biphenyl-4-carboxamide hydrochloride
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| Structure |
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| Formula |
C29H32ClN3O2
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| Molecular Weight |
490.047
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| Canonical SMILES |
CN1C(=O)CCc2ccc(NC(=O)c3ccc(-c4ccccc4)c(CN4CCCCC4)c3)cc21.Cl
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| InChI |
InChI=1S/C29H31N3O2.ClH/c1-31-27-19-25(13-10-22(27)12-15-28(31)33)30-29(34)23-11-14-26(21-8-4-2-5-9-21)24(18-23)20-32-16-6-3-7-17-32;/h2,4-5,8-11,13-14,18-19H,3,6-7,12,15-17,20H2,1H3,(H,30,34);1H
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| InChIKey |
XKFOXXVXFGVACU-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