General Information of the Compound
| Compound ID |
CP0110223
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| Compound Name |
7-fluoro-N-[1-[(2-fluorophenyl)methyl]piperidin-4-yl]-4-oxochromene-2-carboxamide
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| Structure |
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| Formula |
C22H20F2N2O3
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| Molecular Weight |
398.409
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| Canonical SMILES |
Fc1ccc2c(c1)oc(cc2=O)C(=O)NC1CCN(Cc2ccccc2F)CC1
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| InChI |
InChI=1S/C22H20F2N2O3/c23-15-5-6-17-19(27)12-21(29-20(17)11-15)22(28)25-16-7-9-26(10-8-16)13-14-3-1-2-4-18(14)24/h1-6,11-12,16H,7-10,13H2,(H,25,28)
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| InChIKey |
RKAQEMTZLXQHBE-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