General Information of the Compound
| Compound ID |
CP0551536
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| Compound Name |
4-[4-(2-fluorophenyl)piperazin-1-yl]-8-propan-2-yloxyquinoline-3-carbonitrile
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| Formula |
C23H23FN4O
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| Molecular Weight |
390.462
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| Canonical SMILES |
CC(C)Oc1cccc2c(N3CCN(CC3)c3ccccc3F)c(cnc12)C#N
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| InChI |
InChI=1S/C23H23FN4O/c1-16(2)29-21-9-5-6-18-22(21)26-15-17(14-25)23(18)28-12-10-27(11-13-28)20-8-4-3-7-19(20)24/h3-9,15-16H,10-13H2,1-2H3
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| InChIKey |
WEBXONZQIONYBK-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