General Information of the Compound
| Compound ID |
CP0433287
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| Compound Name |
5-[4-[2-(methylamino)ethoxy]phenyl]-6-phenyl-8,9-dihydro-7H-benzo[7]annulen-2-ol
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| Structure |
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| Formula |
C26H27NO2
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| Molecular Weight |
385.507
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| Canonical SMILES |
CNCCOc1ccc(cc1)C1=C(CCCc2cc(O)ccc12)c1ccccc1
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| InChI |
InChI=1S/C26H27NO2/c1-27-16-17-29-23-13-10-20(11-14-23)26-24(19-6-3-2-4-7-19)9-5-8-21-18-22(28)12-15-25(21)26/h2-4,6-7,10-15,18,27-28H,5,8-9,16-17H2,1H3
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| InChIKey |
IMOBZLOHQXJCDZ-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