General Information of the Compound
| Compound ID |
CP0249270
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| Compound Name |
4-[2-[(3E)-3-[(4-methoxynaphthalen-1-yl)methylidene]inden-1-yl]ethyl]morpholine
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| Structure |
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| Formula |
C27H27NO2
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| Molecular Weight |
397.518
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| Canonical SMILES |
COc1ccc(\C=C2/C=C(CCN3CCOCC3)c3ccccc23)c2ccccc12
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| InChI |
InChI=1S/C27H27NO2/c1-29-27-11-10-20(24-7-4-5-9-26(24)27)18-22-19-21(23-6-2-3-8-25(22)23)12-13-28-14-16-30-17-15-28/h2-11,18-19H,12-17H2,1H3/b22-18+
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| InChIKey |
YKCYUNDBAMPXFG-RELWKKBWSA-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