Compound Synopsis
Compound Overview
Bioactivity Data Summary
Protein Affinity Profile
Cellline Sensitivity Profile

1010948 - Overview - Compound Synopsis

Synonyms
Molecular Formula
C20H31N3O12S2
InChI
InChI=1S/C20H31N3O12S2/c21-37(31,32)9-3-1-8(2-4-9)5-22-20(36)23-18-15(29)14(28)17(11(7-25)33-18)35-19-16(30)13(27)12(26)10(6-24)34-19/h1-4,10-19,24-30H,5-7H2,(H2,21,31,32)(H2,22,23,36)/t10-,11-,12-,13+,14-,15-,16-,17-,18-,19-/m1/s1
Smiles
NS(=O)(=O)c1ccc(CNC(=S)N[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)cc1
Cross References
UniChem27234101
canSAR1010948
ChEMBLCHEMBL1956768
BindingDB50366062
Commercially Available
Unknown


MOLECULAR_WEIGHT ALOGP HBOND_DONORS HBOND_ACCEPTORS ATOMS CONTAINS_TOXICOPHORE
Properties 569.134915432-5.0778111568No


Compounds with the same scaffold


Image of compound ID: 1010948
Murko Scaffold Family: 938 compoundsClick here to open a new canSAR search with these compounds

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