General Information of the Compound
| Compound ID |
CP0569742
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| Compound Name |
2-[[2-(benzylsulfonylamino)-6-oxo-1H-pyrimidine-5-carbonyl]amino]acetic acid
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| Structure |
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| Formula |
C14H14N4O6S
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| Molecular Weight |
366.355
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| Canonical SMILES |
OC(=O)CNC(=O)c1cnc(NS(=O)(=O)Cc2ccccc2)nc1O
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| InChI |
InChI=1S/C14H14N4O6S/c19-11(20)7-15-12(21)10-6-16-14(17-13(10)22)18-25(23,24)8-9-4-2-1-3-5-9/h1-6H,7-8H2,(H,15,21)(H,19,20)(H2,16,17,18,22)
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| InChIKey |
RAQFJQAUSXIUGC-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