General Information of the Compound
| Compound ID |
CP0441259
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| Compound Name |
(E)-3-(3,4-dichlorophenyl)-1-(1-hydroxynaphthalen-2-yl)prop-2-en-1-one
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| Structure |
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| Formula |
C19H12Cl2O2
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| Molecular Weight |
343.209
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| Canonical SMILES |
Oc1c(ccc2ccccc12)C(=O)\C=C\c1ccc(Cl)c(Cl)c1
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| InChI |
InChI=1S/C19H12Cl2O2/c20-16-9-5-12(11-17(16)21)6-10-18(22)15-8-7-13-3-1-2-4-14(13)19(15)23/h1-11,23H/b10-6+
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| InChIKey |
PVJIQEOVQSCJKX-UXBLZVDNSA-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