COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK426873
Chemical Name: N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)-1,3-benzodioxole-5-carboxamide
Smiles: N#Cc1c(NC(=O)c2ccc3c(c2)OCO3)sc(c1CC)C

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Molecular Weight: 314.36
Empirical Formula: C16H14N2O3S

Physical State: Dry powder
Available Amount: 1568 mg

Lipinsky:
logP: 3.407
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 99
Number of rings: 3

     

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