General Information of the Compound
| Compound ID |
CP0481781
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| Compound Name |
US10028961, Compound 301
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| Structure |
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| Formula |
C15H16F4N6O
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| Molecular Weight |
372.326
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| Canonical SMILES |
Cc1nc(co1)-c1nc(NC2CC(F)(F)C2)nc(NC2CC(F)(F)C2)n1
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| InChI |
InChI=1S/C15H16F4N6O/c1-7-20-10(6-26-7)11-23-12(21-8-2-14(16,17)3-8)25-13(24-11)22-9-4-15(18,19)5-9/h6,8-9H,2-5H2,1H3,(H2,21,22,23,24,25)
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| InChIKey |
YBHPSBQYBQRDEV-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