General Information of the Compound
| Compound ID |
CP0459026
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| Compound Name |
US9085584, 103c
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| Structure |
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| Formula |
C19H15F4N5O
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| Molecular Weight |
405.355
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| Canonical SMILES |
Cc1nc2ccc(nc2n2c(nnc12)-c1cc(ccc1F)C(C)(C)O)C(F)(F)F
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| InChI |
InChI=1S/C19H15F4N5O/c1-9-15-26-27-16(11-8-10(18(2,3)29)4-5-12(11)20)28(15)17-13(24-9)6-7-14(25-17)19(21,22)23/h4-8,29H,1-3H3
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| InChIKey |
KPJWOTOSLRSQKP-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