General Information of the Compound
| Compound ID |
CP0443916
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| Compound Name |
4-[5-[[2-(5-fluoro-1-benzofuran-3-yl)ethylamino]methyl]furan-2-yl]phenol
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| Structure |
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| Formula |
C21H18FNO3
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| Molecular Weight |
351.377
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| Canonical SMILES |
Oc1ccc(cc1)-c1ccc(CNCCc2coc3ccc(F)cc23)o1
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| InChI |
InChI=1S/C21H18FNO3/c22-16-3-7-21-19(11-16)15(13-25-21)9-10-23-12-18-6-8-20(26-18)14-1-4-17(24)5-2-14/h1-8,11,13,23-24H,9-10,12H2
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| InChIKey |
NLWTWRZMLJHCRI-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