General Information of the Compound
| Compound ID |
CP0382201
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| Compound Name |
4-[5-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]furan-2-yl]phenol
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| Structure |
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| Formula |
C22H23NO4
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| Molecular Weight |
365.429
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| Canonical SMILES |
COc1cc2CCN(Cc3ccc(o3)-c3ccc(O)cc3)Cc2cc1OC
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| InChI |
InChI=1S/C22H23NO4/c1-25-21-11-16-9-10-23(13-17(16)12-22(21)26-2)14-19-7-8-20(27-19)15-3-5-18(24)6-4-15/h3-8,11-12,24H,9-10,13-14H2,1-2H3
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| InChIKey |
BUOJXZVSZKMNSY-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