General Information of the Compound
| Compound ID |
CP0388626
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| Compound Name |
5-(2-Methylquinolin-7-yl)-2-(4-fluorophenyl)benzonitrile
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| Structure |
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| Formula |
C23H15FN2
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| Molecular Weight |
338.385
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| Canonical SMILES |
Cc1ccc2ccc(cc2n1)-c1ccc(-c2ccc(F)cc2)c(c1)C#N
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| InChI |
InChI=1S/C23H15FN2/c1-15-2-3-17-4-5-19(13-23(17)26-15)18-8-11-22(20(12-18)14-25)16-6-9-21(24)10-7-16/h2-13H,1H3
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| InChIKey |
PQZMWEWZHYNTAZ-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