General Information of the Compound
| Compound ID |
CP0549981
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| Compound Name |
US9212171, 24
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| Structure |
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| Formula |
C20H19FN2O
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| Molecular Weight |
322.383
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| Canonical SMILES |
CN1CCCCC(c2ccc(cn2)C#Cc2cccc(F)c2)C1=O
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| InChI |
InChI=1S/C20H19FN2O/c1-23-12-3-2-7-18(20(23)24)19-11-10-16(14-22-19)9-8-15-5-4-6-17(21)13-15/h4-6,10-11,13-14,18H,2-3,7,12H2,1H3
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| InChIKey |
DKVPZAWYFAHXFF-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