General Information of the Compound
| Compound ID |
CP0579961
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| Compound Name |
2-[[6-oxo-2-[[4-(trifluoromethyl)phenyl]sulfonylamino]-1H-pyrimidine-5-carbonyl]amino]acetic acid
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| Structure |
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| Formula |
C14H11F3N4O6S
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| Molecular Weight |
420.325
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| Canonical SMILES |
OC(=O)CNC(=O)c1cnc(NS(=O)(=O)c2ccc(cc2)C(F)(F)F)nc1O
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| InChI |
InChI=1S/C14H11F3N4O6S/c15-14(16,17)7-1-3-8(4-2-7)28(26,27)21-13-19-5-9(12(25)20-13)11(24)18-6-10(22)23/h1-5H,6H2,(H,18,24)(H,22,23)(H2,19,20,21,25)
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| InChIKey |
SUENHWKSFWUJEQ-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