General Information of the Compound
| Compound ID |
CP0384933
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| Compound Name |
1-(2,4-difluorophenoxy)isoquinoline
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| Structure |
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| Formula |
C15H9F2NO
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| Molecular Weight |
257.239
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| Canonical SMILES |
Fc1ccc(Oc2nccc3ccccc23)c(F)c1
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| InChI |
InChI=1S/C15H9F2NO/c16-11-5-6-14(13(17)9-11)19-15-12-4-2-1-3-10(12)7-8-18-15/h1-9H
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| InChIKey |
SPMLDYAYUULMCM-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