COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK438200
Chemical Name: (2E)-N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)-3-(3-nitrophenyl)prop-2-enamide
Smiles: N#Cc1c(NC(=O)/C=C/c2cccc(c2)[N+](=O)[O-])sc(c1CC)C

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Molecular Weight: 341.39
Empirical Formula: C17H15N3O3S

Physical State: Dry powder
Available Amount: 184 mg

Lipinsky:
logP: 5.009
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 126
Number of rings: 2

     

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