General Information of the Compound
| Compound ID |
CP0573291
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| Compound Name |
US9255103, 13
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| Structure |
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| Formula |
C20H16F3N3O2
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| Molecular Weight |
387.361
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| Canonical SMILES |
Fc1cccc(OCc2cc3CN(CCn3n2)C(=O)c2ccc(F)c(F)c2)c1
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| InChI |
InChI=1S/C20H16F3N3O2/c21-14-2-1-3-17(9-14)28-12-15-10-16-11-25(6-7-26(16)24-15)20(27)13-4-5-18(22)19(23)8-13/h1-5,8-10H,6-7,11-12H2
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| InChIKey |
KEVMXEVGWMIWSP-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