COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL019557
Chemical Name: (2E)-4-{[3-(methoxycarbonyl)-4,5-dimethylthiophen-2-yl]amino}-4-oxobut-2-enoicacid
Smiles: COC(=O)c1c(NC(=O)/C=C/C(=O)O)sc(c1C)C

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Molecular Weight: 283.3
Empirical Formula: C12H13NO5S

Physical State: Dry powder
Available Amount: 110 mg

Lipinsky:
logP: 3.643
Rotatable bonds: 5
H-donors: 2
H-acceptors: 5
PSA: 120
Number of rings: 1

     

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