General Information of the Compound
| Compound ID |
CP0512284
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| Compound Name |
US9187424, 190
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| Structure |
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| Formula |
C33H26F7N3O4
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| Molecular Weight |
661.574
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| Canonical SMILES |
Cc1ccc(cc1)C1=C(NC(=O)c2cc(no2)-c2cccc(F)c2)C(=O)NC(C1)(c1ccc(OCCCC(F)(F)F)cc1)C(F)(F)F
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| InChI |
InChI=1S/C33H26F7N3O4/c1-19-6-8-20(9-7-19)25-18-31(33(38,39)40,22-10-12-24(13-11-22)46-15-3-14-32(35,36)37)42-30(45)28(25)41-29(44)27-17-26(43-47-27)21-4-2-5-23(34)16-21/h2,4-13,16-17H,3,14-15,18H2,1H3,(H,41,44)(H,42,45)
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| InChIKey |
KUEJBZSOEGABCV-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