General Information of the Compound
| Compound ID |
CP0961927
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| Compound Name |
US9187424, 284
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| Structure |
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| Formula |
C27H23F10N5O2
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| Molecular Weight |
639.494
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| Canonical SMILES |
O=C1NC(c2ccc(OCCCCCC(F)(F)F)cc2F)(C(F)(F)F)CC(c2ccc(CC(F)(F)F)cc2)=C1c1nn[nH]n1
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| InChI |
InChI=1S/C27H23F10N5O2/c28-20-12-17(44-11-3-1-2-10-25(29,30)31)8-9-19(20)24(27(35,36)37)14-18(21(23(43)38-24)22-39-41-42-40-22)16-6-4-15(5-7-16)13-26(32,33)34/h4-9,12H,1-3,10-11,13-14H2,(H,38,43)(H,39,40,41,42)
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| InChIKey |
FDCHLQWJYSPTMP-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