General Information of the Compound
| Compound ID |
CP0919086
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| Compound Name |
2-(2-bromobenzylidene)-6-hydroxy-3,4-dihydronaphthalen-1(2H)-one
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| Structure |
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| Formula |
C17H13BrO2
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| Molecular Weight |
329.193
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| Canonical SMILES |
O=C1/C(=C/c2ccccc2Br)CCc2cc(O)ccc21
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| InChI |
InChI=1S/C17H13BrO2/c18-16-4-2-1-3-12(16)9-13-6-5-11-10-14(19)7-8-15(11)17(13)20/h1-4,7-10,19H,5-6H2/b13-9+
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| InChIKey |
HNYNQFHAPYTDTM-UKTHLTGXSA-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