General Information of the Compound
| Compound ID |
CP0503984
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| Compound Name |
US9199981, F156
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| Structure |
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| Formula |
C22H20FN5O2
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| Molecular Weight |
405.433
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| Canonical SMILES |
CC1(C)CC(C1)c1nc(no1)-c1ccc(F)c(NC(=O)c2cnc3ccccn23)c1
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| InChI |
InChI=1S/C22H20FN5O2/c1-22(2)10-14(11-22)21-26-19(27-30-21)13-6-7-15(23)16(9-13)25-20(29)17-12-24-18-5-3-4-8-28(17)18/h3-9,12,14H,10-11H2,1-2H3,(H,25,29)
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| InChIKey |
HHUBMCNSFFNTCO-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