COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK447118
Chemical Name: (2E)-4-{[5-(diethylcarbamoyl)-3-(methoxycarbonyl)-4-methylthiophen-2-yl]amino}-4-oxobut-2-enoicacid
Smiles: CCN(C(=O)c1sc(c(c1C)C(=O)OC)NC(=O)/C=C/C(=O)O)CC

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Molecular Weight: 368.41
Empirical Formula: C16H20N2O6S

Physical State: Dry powder
Available Amount: 2530 mg

Lipinsky:
logP: 3.727
Rotatable bonds: 8
H-donors: 2
H-acceptors: 6
PSA: 141
Number of rings: 1

     

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