General Information of the Compound
| Compound ID |
CP0440063
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| Compound Name |
4-[2-[2-(methylamino)ethoxy]-6-phenyl-8,9-dihydro-7H-benzo[7]annulen-5-yl]phenol
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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 |
CNCCOc1ccc2c(CCCC(c3ccccc3)=C2c2ccc(O)cc2)c1
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| InChI |
InChI=1S/C26H27NO2/c1-27-16-17-29-23-14-15-25-21(18-23)8-5-9-24(19-6-3-2-4-7-19)26(25)20-10-12-22(28)13-11-20/h2-4,6-7,10-15,18,27-28H,5,8-9,16-17H2,1H3
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| InChIKey |
KMEODEUIEXFXBB-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