General Information of the Compound
| Compound ID |
CP0959815
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| Compound Name |
N-(3-methoxyphenyl)-2-(piperidin-1-ylmethyl)biphenyl-4-carboxamidehydrochloride
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| Structure |
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| Formula |
C26H29ClN2O2
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| Molecular Weight |
436.983
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| Canonical SMILES |
COc1cccc(NC(=O)c2ccc(-c3ccccc3)c(CN3CCCCC3)c2)c1.Cl
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| InChI |
InChI=1S/C26H28N2O2.ClH/c1-30-24-12-8-11-23(18-24)27-26(29)21-13-14-25(20-9-4-2-5-10-20)22(17-21)19-28-15-6-3-7-16-28;/h2,4-5,8-14,17-18H,3,6-7,15-16,19H2,1H3,(H,27,29);1H
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| InChIKey |
KNTGLWJZILUPSW-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