COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK008208
Chemical Name: 2,6-di-tert-butyl-4-{(E)-[2-(1,1-dioxido-1,2-benzothiazol-3-yl)hydrazinylidene]methyl}phenol
Smiles: Oc1c(cc(cc1C(C)(C)C)/C=N/NC1=NS(=O)(=O)c2c1cccc2)C(C)(C)C

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Molecular Weight: 413.54
Empirical Formula: C22H27N3O3S

Physical State: Dry powder
Available Amount: 130 mg

Lipinsky:
logP: 5.634
Rotatable bonds: 2
H-donors: 2
H-acceptors: 3
PSA: 91
Number of rings: 3

     

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