General Information of the Compound
| Compound ID |
CP0533231
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| Compound Name |
4-[4-(morpholine-4-carbonyl)anilino]-2-[3-[[4-(trifluoromethyl)benzoyl]amino]phenyl]-1,3-thiazole-5-carboxamide
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| Structure |
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| Formula |
C29H24F3N5O4S
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| Molecular Weight |
595.603
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| Canonical SMILES |
NC(=O)c1sc(nc1Nc1ccc(cc1)C(=O)N1CCOCC1)-c1cccc(NC(=O)c2ccc(cc2)C(F)(F)F)c1
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| InChI |
InChI=1S/C29H24F3N5O4S/c30-29(31,32)20-8-4-17(5-9-20)26(39)35-22-3-1-2-19(16-22)27-36-25(23(42-27)24(33)38)34-21-10-6-18(7-11-21)28(40)37-12-14-41-15-13-37/h1-11,16,34H,12-15H2,(H2,33,38)(H,35,39)
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| InChIKey |
XXXUHZFWMQALKO-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