COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL009999
Chemical Name: (2-isothiocyanatoethyl)benzene
Smiles: S=C=NCCc1ccccc1

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Molecular Weight: 163.24
Empirical Formula: C9H9NS

Physical State: Dry powder
Available Amount: 1000 mg

Lipinsky:
logP: 3.47
Rotatable bonds: 2
H-donors: 0
H-acceptors: 0
PSA: 44
Number of rings: 1

     

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