General Information of the Compound
| Compound ID |
CP0563485
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| Compound Name |
US10806720, Compound 1063
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| Structure |
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| Formula |
C19H14F4N6O2
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| Molecular Weight |
434.353
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| Canonical SMILES |
C[C@](O)(Cn1cc(nn1)-c1ccc(F)cc1)C(=O)Nc1cnc(C#N)c(c1)C(F)(F)F
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| InChI |
InChI=1S/C19H14F4N6O2/c1-18(31,10-29-9-16(27-28-29)11-2-4-12(20)5-3-11)17(30)26-13-6-14(19(21,22)23)15(7-24)25-8-13/h2-6,8-9,31H,10H2,1H3,(H,26,30)/t18-/m0/s1
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| InChIKey |
DHLFALGEKMYIFT-SFHVURJKSA-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