General Information of the Compound
| Compound ID |
CP0479417
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| Compound Name |
4-[(E)-(4-phenylpiperidin-1-yl)iminomethyl]benzene-1,3-diol
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| Structure |
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| Formula |
C18H20N2O2
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| Molecular Weight |
296.37
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| Canonical SMILES |
Oc1ccc(\C=N\N2CCC(CC2)c2ccccc2)c(O)c1
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| InChI |
InChI=1S/C18H20N2O2/c21-17-7-6-16(18(22)12-17)13-19-20-10-8-15(9-11-20)14-4-2-1-3-5-14/h1-7,12-13,15,21-22H,8-11H2/b19-13+
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| InChIKey |
NWSFUOLAJZBQND-CPNJWEJPSA-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