COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL016825
Chemical Name: methyl2-isothiocyanato-5-methylthiophene-3-carboxylate
Smiles: S=C=Nc1sc(cc1C(=O)OC)C

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Molecular Weight: 213.28
Empirical Formula: C8H7NO2S2

Physical State: Dry powder
Available Amount: 2203 mg

Lipinsky:
logP: 4.126
Rotatable bonds: 2
H-donors: 0
H-acceptors: 2
PSA: 98
Number of rings: 1

     

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