General Information of the Compound
| Compound ID |
CP0115837
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| Compound Name |
4-[C-(4-hydroxyphenyl)-N-(2-methylphenyl)carbonimidoyl]phenol
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| Structure |
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| Formula |
C20H17NO2
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| Molecular Weight |
303.361
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| Canonical SMILES |
Cc1ccccc1N=C(c1ccc(O)cc1)c1ccc(O)cc1
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| InChI |
InChI=1S/C20H17NO2/c1-14-4-2-3-5-19(14)21-20(15-6-10-17(22)11-7-15)16-8-12-18(23)13-9-16/h2-13,22-23H,1H3
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| InChIKey |
NPBTTYXOISVXOO-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
Protein ID: PT00886, Estrogen receptor
Protein ID: PT00889, Estrogen receptor beta