General Information of the Compound
| Compound ID |
CP0533930
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| Compound Name |
US10077266, Example 151
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| Structure |
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| Formula |
C24H27F4N5O2
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| Molecular Weight |
493.505
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| Canonical SMILES |
CC(=O)N1CCc2nc(N3CCC(CC3)Oc3ccc(F)cc3F)c(NC3CC(F)(F)C3)nc2C1
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| InChI |
InChI=1S/C24H27F4N5O2/c1-14(34)33-9-6-19-20(13-33)30-22(29-16-11-24(27,28)12-16)23(31-19)32-7-4-17(5-8-32)35-21-3-2-15(25)10-18(21)26/h2-3,10,16-17H,4-9,11-13H2,1H3,(H,29,30)
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| InChIKey |
KCSNHUSEVYLGAW-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