COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK378065
Chemical Name: (5E)-5-[(1Z)-1-(3-ethyl-5-methoxy-1,3-benzothiazol-2(3H)-ylidene)butan-2-ylidene]-3-(prop-2-en-1-yl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: C=CCN1C(=S)S/C(=C(/C=c/2\sc3c(n2CC)cc(cc3)OC)\CC)/C1=O

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Molecular Weight: 418.6
Empirical Formula: C20H22N2O2S3

Physical State: Dry powder
Available Amount: 507 mg

Lipinsky:
logP: 2.791
Rotatable bonds: 6
H-donors: 0
H-acceptors: 2
PSA: 115
Number of rings: 3

     

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