COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK442289
Chemical Name: (2E)-3-(1,3-benzodioxol-5-yl)-N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)prop-2-enamide
Smiles: N#Cc1c(NC(=O)/C=C/c2ccc3c(c2)OCO3)sc(c1CC)C

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Molecular Weight: 340.4
Empirical Formula: C18H16N2O3S

Physical State: Dry powder
Available Amount: 80 mg

Lipinsky:
logP: 5.23
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 99
Number of rings: 3

     

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