General Information of the Compound
| Compound ID |
CP0395785
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| Compound Name |
(E)-1-(1-hydroxynaphthalen-2-yl)-3-(3-methoxyphenyl)prop-2-en-1-one
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| Structure |
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| Formula |
C20H16O3
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| Molecular Weight |
304.345
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| Canonical SMILES |
COc1cccc(\C=C\C(=O)c2ccc3ccccc3c2O)c1
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| InChI |
InChI=1S/C20H16O3/c1-23-16-7-4-5-14(13-16)9-12-19(21)18-11-10-15-6-2-3-8-17(15)20(18)22/h2-13,22H,1H3/b12-9+
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| InChIKey |
VLWVNUOUJXQVQQ-FMIVXFBMSA-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