General Information of the Compound
| Compound ID |
CP0414239
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| Compound Name |
US9187424, 11
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| Structure |
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| Formula |
C31H28F6N2O4
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| Molecular Weight |
606.563
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| Canonical SMILES |
Cc1ccc(cc1)C1=C(C(=O)Nc2ccc(OC(F)(F)F)cc2)C(=O)NC(C)(C1)c1ccc(OCCCC(F)(F)F)cc1
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| InChI |
InChI=1S/C31H28F6N2O4/c1-19-4-6-20(7-5-19)25-18-29(2,21-8-12-23(13-9-21)42-17-3-16-30(32,33)34)39-28(41)26(25)27(40)38-22-10-14-24(15-11-22)43-31(35,36)37/h4-15H,3,16-18H2,1-2H3,(H,38,40)(H,39,41)
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| InChIKey |
RANCPNIFZRWTRC-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