General Information of the Compound
| Compound ID |
CP0504066
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| Compound Name |
US9133168, Example 24b
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| Structure |
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| Formula |
C19H14F2N4O2
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| Molecular Weight |
368.343
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| Canonical SMILES |
Fc1cc(ccn1)-c1cc(=O)[nH]c(CC(=O)N2CCc3c2cccc3F)n1
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| InChI |
InChI=1S/C19H14F2N4O2/c20-13-2-1-3-15-12(13)5-7-25(15)19(27)10-17-23-14(9-18(26)24-17)11-4-6-22-16(21)8-11/h1-4,6,8-9H,5,7,10H2,(H,23,24,26)
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| InChIKey |
BNKDUJYYNUICRN-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