General Information of the Compound
| Compound ID |
CP0954424
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| Compound Name |
N-(3-hydroxyphenyl)-2-(piperidin-1-ylmethyl)biphenyl-4-carboxamide hydrochloride
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| Structure |
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| Formula |
C25H27ClN2O2
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| Molecular Weight |
422.956
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| Canonical SMILES |
Cl.O=C(Nc1cccc(O)c1)c1ccc(-c2ccccc2)c(CN2CCCCC2)c1
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| InChI |
InChI=1S/C25H26N2O2.ClH/c28-23-11-7-10-22(17-23)26-25(29)20-12-13-24(19-8-3-1-4-9-19)21(16-20)18-27-14-5-2-6-15-27;/h1,3-4,7-13,16-17,28H,2,5-6,14-15,18H2,(H,26,29);1H
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| InChIKey |
YSFVQLATCHJDFI-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