General Information of the Compound
| Compound ID |
CP0414212
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| Compound Name |
US9187424, 94
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| Structure |
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| Formula |
C30H24F9NO3
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| Molecular Weight |
617.508
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| Canonical SMILES |
Cc1ccc(cc1)C1=C(C(=O)NC(C1)(c1ccc(OCCCC(F)(F)F)cc1)C(F)(F)F)c1ccc(OC(F)(F)F)cc1
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| InChI |
InChI=1S/C30H24F9NO3/c1-18-3-5-19(6-4-18)24-17-27(29(34,35)36,21-9-13-22(14-10-21)42-16-2-15-28(31,32)33)40-26(41)25(24)20-7-11-23(12-8-20)43-30(37,38)39/h3-14H,2,15-17H2,1H3,(H,40,41)
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| InChIKey |
DGAUUMYBINSHPH-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