General Information of the Compound
| Compound ID |
CP0519023
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| Compound Name |
N-[[5-(3,5-dichlorophenyl)furan-2-yl]methyl]-2-(1H-indol-3-yl)ethanamine
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| Structure |
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| Formula |
C21H18Cl2N2O
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| Molecular Weight |
385.294
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| Canonical SMILES |
Clc1cc(Cl)cc(c1)-c1ccc(CNCCc2c[nH]c3ccccc23)o1
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| InChI |
InChI=1S/C21H18Cl2N2O/c22-16-9-15(10-17(23)11-16)21-6-5-18(26-21)13-24-8-7-14-12-25-20-4-2-1-3-19(14)20/h1-6,9-12,24-25H,7-8,13H2
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| InChIKey |
WOPKUDWAWHMAHU-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