COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK500355
Chemical Name: 1-(3-isothiocyanatophenyl)ethanone
Smiles: S=C=Nc1cccc(c1)C(=O)C

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Molecular Weight: 177.23
Empirical Formula: C9H7NOS

Physical State: Dry powder
Available Amount: 1100 mg

Lipinsky:
logP: 2.747
Rotatable bonds: 1
H-donors: 0
H-acceptors: 1
PSA: 61
Number of rings: 1

     

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