COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL010800
Chemical Name: 3-isothiocyanatotetrahydrothiophene1,1-dioxide
Smiles: S=C=NC1CCS(=O)(=O)C1

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Molecular Weight: 177.25
Empirical Formula: C5H7NO2S2

Physical State: Dry powder
Available Amount: 1010 mg

Lipinsky:
logP: -0.174
Rotatable bonds: 1
H-donors: 0
H-acceptors: 2
PSA: 86
Number of rings: 1

     

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