General Information of the Compound
| Compound ID |
CP0411707
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| Compound Name |
(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[5-(4-hydroxyphenyl)furan-2-yl]methanone
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| Structure |
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| Formula |
C22H21NO5
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| Molecular Weight |
379.412
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| Canonical SMILES |
COc1cc2CCN(Cc2cc1OC)C(=O)c1ccc(o1)-c1ccc(O)cc1
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| InChI |
InChI=1S/C22H21NO5/c1-26-20-11-15-9-10-23(13-16(15)12-21(20)27-2)22(25)19-8-7-18(28-19)14-3-5-17(24)6-4-14/h3-8,11-12,24H,9-10,13H2,1-2H3
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| InChIKey |
RVMCLYRTOLRSTD-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