EZATIOSTAT

Search structure
Synonyms:
Status: Phase 2
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: 057D10I8S8

Structure
InChI Key GWEJFLVSOGNLSS-WPFOTENUSA-N
Smile CCOC(=O)[C@@H](N)CCC(=O)N[C@@H](CSCc1ccccc1)C(=O)N[C@@H](C(=O)OCC)c1ccccc1
InChI
InChI=1S/C27H35N3O6S/c1-3-35-26(33)21(28)15-16-23(31)29-22(18-37-17-19-11-7-5-8-12-19)25(32)30-24(27(34)36-4-2)20-13-9-6-10-14-20/h5-14,21-22,24H,3-4,15-18,28H2,1-2H3,(H,29,31)(H,30,32)/t21-,22-,24+/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C27H35N3O6S
Molecular Weight 529.66
AlogP 2.5
Hydrogen Bond Acceptor 8.0
Hydrogen Bond Donor 3.0
Number of Rotational Bond 15.0
Polar Surface Area 136.82
Molecular species NEUTRAL
Aromatic Rings 2.0
Heavy Atoms 37.0

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Myelodysplastic Syndromes 1 D009190 ClinicalTrials

Cross References

Resources Reference
ChEMBL CHEMBL2110585
DrugBank DB05460
EPA CompTox DTXSID40168592
FDA SRS 057D10I8S8
PubChem 5310939
SureChEMBL SCHEMBL420400
ZINC ZINC000056898832
CONTENTS