COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK381653
Chemical Name: (5Z)-5-[(1E)-1-(3-ethyl-5-methoxy-1,3-benzothiazol-2(3H)-ylidene)butan-2-ylidene]-3-(2-phenylethyl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: CC/C(=C\1/SC(=S)N(C1=O)CCc1ccccc1)/C=c\1/sc2c(n1CC)cc(cc2)OC

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Molecular Weight: 482.69
Empirical Formula: C25H26N2O2S3

Physical State: Dry powder
Available Amount: 808 mg

Lipinsky:
logP: 4.117
Rotatable bonds: 6
H-donors: 0
H-acceptors: 2
PSA: 115
Number of rings: 4

     

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