General Information of the Compound
| Compound ID |
CP0515423
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| Compound Name |
US9187424, 152
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| Structure |
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| Formula |
C27H23F6N3O4
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| Molecular Weight |
567.486
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| Canonical SMILES |
Cc1ccc(cc1)C1=C(NC(=O)c2cnco2)C(=O)NC(C1)(c1ccc(OCCCC(F)(F)F)cc1)C(F)(F)F
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| InChI |
InChI=1S/C27H23F6N3O4/c1-16-3-5-17(6-4-16)20-13-25(27(31,32)33,36-24(38)22(20)35-23(37)21-14-34-15-40-21)18-7-9-19(10-8-18)39-12-2-11-26(28,29)30/h3-10,14-15H,2,11-13H2,1H3,(H,35,37)(H,36,38)
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| InChIKey |
SZPIHOZNXSWAPH-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