COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL030187
Chemical Name: 3-isothiocyanato-2,5-dihydrothiophene1,1-dioxide
Smiles: S=C=NC1=CCS(=O)(=O)C1

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Molecular Weight: 175.23
Empirical Formula: C5H5NO2S2

Physical State: Dry powder
Available Amount: 1013 mg

Lipinsky:
logP: 0.897
Rotatable bonds: 0
H-donors: 0
H-acceptors: 2
PSA: 86
Number of rings: 1

     

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