General Information of the Compound
| Compound ID |
CP0552542
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| Compound Name |
(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[5-(2,3-dimethoxyphenyl)furan-2-yl]methanone
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| Formula |
C24H25NO6
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| Molecular Weight |
423.465
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| Canonical SMILES |
COc1cccc(-c2ccc(o2)C(=O)N2CCc3cc(OC)c(OC)cc3C2)c1OC
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| InChI |
InChI=1S/C24H25NO6/c1-27-19-7-5-6-17(23(19)30-4)18-8-9-20(31-18)24(26)25-11-10-15-12-21(28-2)22(29-3)13-16(15)14-25/h5-9,12-13H,10-11,14H2,1-4H3
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| InChIKey |
ZQEYGUWPLKWCSF-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