COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK043013
Chemical Name: (2Z)-2-(1,3-benzothiazol-2-yl)-3-[4-(methylsulfanyl)phenyl]prop-2-enenitrile
Smiles: CSc1ccc(cc1)/C=C(\c1nc2c(s1)cccc2)/C#N

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Molecular Weight: 308.43
Empirical Formula: C17H12N2S2

Physical State: Dry powder
Available Amount: 99 mg

Lipinsky:
logP: 5.276
Rotatable bonds: 1
H-donors: 0
H-acceptors: 0
PSA: 90
Number of rings: 3

     

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