COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK628164
Chemical Name: [5-chloro-2-(methylsulfanyl)phenyl]({[(Z)-(6,7-dimethoxyisoquinolin-1-yl)(3,4-dimethoxyphenyl)methylidene]amino}oxy)methanone
Smiles: COc1cc(ccc1OC)/C(=N/OC(=O)c1cc(Cl)ccc1SC)/c1nccc2c1cc(OC)c(c2)OC

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Molecular Weight: 553.04
Empirical Formula: C28H25ClN2O6S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.723
Rotatable bonds: 10
H-donors: 0
H-acceptors: 6
PSA: 113
Number of rings: 4

     

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