General Information of the Compound
| Compound ID |
CP0958477
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| Compound Name |
N-(3-((6,7-Dimethoxyquinolin-4-yl)oxy)phenyl)-N-(4-(4-propionamidopiperidin-1-yl)-3-(trifluoromethyl)phenyl)-cyclopropane 1,1-Dicarboxamide
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| Structure |
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| Formula |
C37H38F3N5O6
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| Molecular Weight |
705.734
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| Canonical SMILES |
CCC(=O)NC1CCN(c2ccc(NC(=O)C3(C(=O)Nc4cccc(Oc5ccnc6cc(OC)c(OC)cc56)c4)CC3)cc2C(F)(F)F)CC1
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| InChI |
InChI=1S/C37H38F3N5O6/c1-4-33(46)42-22-11-16-45(17-12-22)29-9-8-24(19-27(29)37(38,39)40)44-35(48)36(13-14-36)34(47)43-23-6-5-7-25(18-23)51-30-10-15-41-28-21-32(50-3)31(49-2)20-26(28)30/h5-10,15,18-22H,4,11-14,16-17H2,1-3H3,(H,42,46)(H,43,47)(H,44,48)
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| InChIKey |
NUZOHCUWVOWXRV-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