General Information of the Compound
| Compound ID |
CP0573405
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| Compound Name |
2-[(2R,3R,4S)-3,4-dihydroxy-5-[6-[2-(4-sulfamoylphenyl)hydrazinyl]purin-9-yl]oxolan-2-yl]-N-ethylacetamide
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| Structure |
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| Formula |
C19H24N8O6S
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| Molecular Weight |
492.518
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| Canonical SMILES |
CCNC(=O)C[C@H]1OC([C@@H](O)[C@H]1O)n1cnc2c(NNc3ccc(cc3)S(N)(=O)=O)ncnc12
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| InChI |
InChI=1S/C19H24N8O6S/c1-2-21-13(28)7-12-15(29)16(30)19(33-12)27-9-24-14-17(22-8-23-18(14)27)26-25-10-3-5-11(6-4-10)34(20,31)32/h3-6,8-9,12,15-16,19,25,29-30H,2,7H2,1H3,(H,21,28)(H2,20,31,32)(H,22,23,26)/t12-,15+,16+,19?/m1/s1
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| InChIKey |
FJFFAMCWDIHKBJ-HWQOSGRBSA-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