COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK050185
Chemical Name: methyl(2E)-2-cyano-3-(5-nitrothiophen-2-yl)prop-2-enoate
Smiles: [O-][N+](=O)c1ccc(s1)/C=C(/C(=O)OC)\C#N

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Molecular Weight: 238.22
Empirical Formula: C9H6N2O4S

Physical State: Dry powder
Available Amount: 129 mg

Lipinsky:
logP: 1.564
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 124
Number of rings: 1

     

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