General Information of the Compound
| Compound ID |
CP0559409
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| Compound Name |
US9199981, F65
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| Structure |
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| Formula |
C23H18F2N8O2
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| Molecular Weight |
476.447
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| Canonical SMILES |
Cc1ccc(cc1NC(=O)c1cnc2cc(ccn12)-c1c[nH]nn1)-c1noc(n1)C1CC(F)(F)C1
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| InChI |
InChI=1S/C23H18F2N8O2/c1-12-2-3-14(20-29-22(35-31-20)15-8-23(24,25)9-15)6-16(12)28-21(34)18-11-26-19-7-13(4-5-33(18)19)17-10-27-32-30-17/h2-7,10-11,15H,8-9H2,1H3,(H,28,34)(H,27,30,32)
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| InChIKey |
IZCWSKVYLGKJTN-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