General Information of the Compound
| Compound ID |
CP0480309
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| Compound Name |
4-(6,7-difluoro-1-methylbenzimidazol-2-yl)isoquinoline
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| Structure |
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| Formula |
C17H11F2N3
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| Molecular Weight |
295.292
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| Canonical SMILES |
Cn1c(nc2ccc(F)c(F)c12)-c1cncc2ccccc12
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| InChI |
InChI=1S/C17H11F2N3/c1-22-16-14(7-6-13(18)15(16)19)21-17(22)12-9-20-8-10-4-2-3-5-11(10)12/h2-9H,1H3
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| InChIKey |
INCMATLUFSMWKH-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