General Information of the Compound
Compound ID |
CP0860850
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Compound Name |
4'-((6,7-Dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-methyl)-3-aminobiphenyl-4-ol
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Structure |
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Formula |
C24H26N2O3
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Molecular Weight |
390.483
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Canonical SMILES |
COc1cc2c(cc1OC)CN(Cc1ccc(-c3ccc(O)c(N)c3)cc1)CC2
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InChI |
InChI=1S/C24H26N2O3/c1-28-23-12-19-9-10-26(15-20(19)13-24(23)29-2)14-16-3-5-17(6-4-16)18-7-8-22(27)21(25)11-18/h3-8,11-13,27H,9-10,14-15,25H2,1-2H3
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InChIKey |
HHXSVAFZPVIUJA-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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ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
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