General Information of the Compound
| Compound ID |
CP0425551
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| Compound Name |
US9199981, F86
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| Structure |
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| Formula |
C24H22F3N5O3
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| Molecular Weight |
485.466
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| Canonical SMILES |
Cc1ccc(cc1NC(=O)c1cnc2ccc(COCC(F)(F)F)cn12)-c1noc(n1)C1CCC1
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| InChI |
InChI=1S/C24H22F3N5O3/c1-14-5-7-17(21-30-23(35-31-21)16-3-2-4-16)9-18(14)29-22(33)19-10-28-20-8-6-15(11-32(19)20)12-34-13-24(25,26)27/h5-11,16H,2-4,12-13H2,1H3,(H,29,33)
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| InChIKey |
MUNJUJLGPXZJIQ-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