COMPOUNDS FOR BIOLOGICAL SCREENING
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Vitas-M Lab ID: STK501677
Chemical Name: 5-isothiocyanato-1,3-benzodioxole
Smiles: S=C=Nc1ccc2c(c1)OCO2

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Molecular Weight: 179.2
Empirical Formula: C8H5NO2S

Physical State: Dry powder
Available Amount: 316 mg

Lipinsky:
logP: 2.651
Rotatable bonds: 0
H-donors: 0
H-acceptors: 2
PSA: 62
Number of rings: 2

     

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