General Information of the Compound
| Compound ID |
CP0347248
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| Compound Name |
US9163008, 2
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| Structure |
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| Formula |
C19H16FN5O3
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| Molecular Weight |
381.367
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| Canonical SMILES |
NC(=O)CNc1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)C(N)=O
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| InChI |
InChI=1S/C19H16FN5O3/c20-12-3-7-14(8-4-12)28-13-5-1-11(2-6-13)19-24-15(18(22)27)9-17(25-19)23-10-16(21)26/h1-9H,10H2,(H2,21,26)(H2,22,27)(H,23,24,25)
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| InChIKey |
WIRIYNCENYMPBP-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