General Information of the Compound
| Compound ID |
CP0869655
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| Compound Name |
N-(1-(4-(3-(3-((6,7-Dimethoxyquinolin-4-yl)oxy)phenyl)-ureido)-2-(trifluoromethyl)phenyl)piperidin-4-yl)acetamide
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| Structure |
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| Formula |
C32H32F3N5O5
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| Molecular Weight |
623.632
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| Canonical SMILES |
COc1cc2nccc(Oc3cccc(NC(=O)Nc4ccc(N5CCC(NC(C)=O)CC5)c(C(F)(F)F)c4)c3)c2cc1OC
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| InChI |
InChI=1S/C32H32F3N5O5/c1-19(41)37-20-10-13-40(14-11-20)27-8-7-22(16-25(27)32(33,34)35)39-31(42)38-21-5-4-6-23(15-21)45-28-9-12-36-26-18-30(44-3)29(43-2)17-24(26)28/h4-9,12,15-18,20H,10-11,13-14H2,1-3H3,(H,37,41)(H2,38,39,42)
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| InChIKey |
VVBWYHFIQPMYIY-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