General Information of the Compound
| Compound ID |
CP0571658
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| Compound Name |
4-[(5,8-dimethyl-6-oxo-7H-pteridin-2-yl)amino]benzenesulfonamide
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| Structure |
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| Formula |
C14H16N6O3S
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| Molecular Weight |
348.388
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| Canonical SMILES |
CN1CC(=O)N(C)c2cnc(Nc3ccc(cc3)S(N)(=O)=O)nc12
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| InChI |
InChI=1S/C14H16N6O3S/c1-19-8-12(21)20(2)11-7-16-14(18-13(11)19)17-9-3-5-10(6-4-9)24(15,22)23/h3-7H,8H2,1-2H3,(H2,15,22,23)(H,16,17,18)
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| InChIKey |
VDELEWVDOLMGPI-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