COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK711112
Chemical Name: 1-chloro-5-isothiocyanato-2,4-dimethoxybenzene
Smiles: S=C=Nc1cc(Cl)c(cc1OC)OC

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Molecular Weight: 229.69
Empirical Formula: C9H8ClNO2S

Physical State: Dry powder
Available Amount: 1000 mg

Lipinsky:
logP: 4.978
Rotatable bonds: 2
H-donors: 0
H-acceptors: 2
PSA: 62
Number of rings: 1

     

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