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

1033214 - Overview - Compound Synopsis

Synonyms
Molecular Formula
C32H42N4O9S
InChI
InChI=1S/C32H42N4O9S/c1-20(2)17-36(46(41,42)22-8-9-26-24(15-22)25(30(39)34-26)16-33-11-12-37)18-28(38)27(14-21-6-4-3-5-7-21)35-32(40)45-29-19-44-31-23(29)10-13-43-31/h3-9,15-16,20,23,27-29,31,33,37-38H,10-14,17-19H2,1-2H3,(H,34,39)(H,35,40)/t23-,27-,28+,29-,31+/m0/s1
Smiles
CC(C)CN(C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)O[C@H]1CO[C@H]2OCC[C@@H]12)S(=O)(=O)c1ccc2c(c1)C(=CNCCO)C(=O)N2
Cross References
UniChem27303015
canSAR1033214
ChEMBLCHEMBL2058313
Commercially Available
Unknown


MOLECULAR_WEIGHT ALOGP HBOND_DONORS HBOND_ACCEPTORS ATOMS CONTAINS_TOXICOPHORE
Properties 658.2672499241.66851388Yes


Compounds with the same scaffold


Image of compound ID: 1033214
Murko Scaffold Family: 18 compoundsClick here to open a new canSAR search with these compounds

Maximum number shown here is 12