COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK378074
Chemical Name: {(5E)-5-[(1Z)-1-(3-ethyl-5-methoxy-1,3-benzothiazol-2(3H)-ylidene)butan-2-ylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}aceticacid
Smiles: CC/C(=C/1\SC(=S)N(C1=O)CC(=O)O)/C=c/1\sc2c(n1CC)cc(cc2)OC

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Molecular Weight: 436.58
Empirical Formula: C19H20N2O4S3

Physical State: Dry powder
Available Amount: 249 mg

Lipinsky:
logP: 1.732
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 152
Number of rings: 3

     

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