COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK682988
Chemical Name: 1-{4-[(4-{4-[(3,5-di-tert-butyl-4-hydroxyphenyl)sulfanyl]-3,5,6-trifluoropyridin-2-yl}piperazin-1-yl)sulfonyl]phenyl}ethanone
Smiles: Fc1c(nc(c(c1Sc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)F)F)N1CCN(CC1)S(=O)(=O)c1ccc(cc1)C(=O)C

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Molecular Weight: 635.77
Empirical Formula: C31H36F3N3O4S2

Physical State: Dry powder
Available Amount: 12 mg

Lipinsky:
logP: 8.016
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 124
Number of rings: 4

     

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