General Information of the Compound
| Compound ID |
CP0541834
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| Compound Name |
6-fluoro-4-[4-(2-fluorophenyl)piperazin-1-yl]-8-hydroxyquinoline-3-carbonitrile
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| Formula |
C20H16F2N4O
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| Molecular Weight |
366.371
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| Canonical SMILES |
Oc1cc(F)cc2c(N3CCN(CC3)c3ccccc3F)c(cnc12)C#N
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| InChI |
InChI=1S/C20H16F2N4O/c21-14-9-15-19(18(27)10-14)24-12-13(11-23)20(15)26-7-5-25(6-8-26)17-4-2-1-3-16(17)22/h1-4,9-10,12,27H,5-8H2
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| InChIKey |
OSPSERAVXYISEI-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