COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK378073
Chemical Name: (4E)-4-[(1Z)-1-(3-ethyl-5-methoxy-1,3-benzothiazol-2(3H)-ylidene)butan-2-ylidene]-2-(ethylsulfanyl)-1,3-thiazol-5(4H)-one
Smiles: CCSC1=N/C(=C(/C=c/2\sc3c(n2CC)cc(cc3)OC)\CC)/C(=O)S1

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Molecular Weight: 406.59
Empirical Formula: C19H22N2O2S3

Physical State: Dry powder
Available Amount: 847 mg

Lipinsky:
logP: 4.098
Rotatable bonds: 6
H-donors: 0
H-acceptors: 2
PSA: 117
Number of rings: 3

     

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