COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK633339
Chemical Name: ethyl4-[(4-butyl-5,7,8-trifluoro-1,1-dioxido-3,4-dihydro-2H-1,4-benzothiazin-6-yl)carbonyl]piperazine-1-carboxylate
Smiles: CCCCN1CCS(=O)(=O)c2c1c(F)c(C(=O)N1CCN(CC1)C(=O)OCC)c(c2F)F

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Molecular Weight: 477.5
Empirical Formula: C20H26F3N3O5S

Physical State: Dry powder
Available Amount: 306 mg

Lipinsky:
logP: 0.191
Rotatable bonds: 6
H-donors: 0
H-acceptors: 5
PSA: 95
Number of rings: 3

     

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