COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL010007
Chemical Name: ethyl2-isothiocyanatobenzoate
Smiles: CCOC(=O)c1ccccc1N=C=S

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Molecular Weight: 207.25
Empirical Formula: C10H9NO2S

Physical State: Dry powder
Available Amount: 1000 mg

Lipinsky:
logP: 4.554
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 70
Number of rings: 1

     

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