General Information of the Compound
| Compound ID |
CP0276695
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| Compound Name |
1-(4-Bromomethyl-phenyl)-2-(4-hydroxy-phenyl)-3H-inden-5-ol
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| Structure |
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| Formula |
C22H17BrO2
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| Molecular Weight |
393.28
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| Canonical SMILES |
Oc1ccc(cc1)C1=C(c2ccc(O)cc2C1)c1ccc(CBr)cc1
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| InChI |
InChI=1S/C22H17BrO2/c23-13-14-1-3-16(4-2-14)22-20-10-9-19(25)11-17(20)12-21(22)15-5-7-18(24)8-6-15/h1-11,24-25H,12-13H2
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| InChIKey |
DSVUWLXFXMLTDM-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