COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK794356
Chemical Name: 2-(1,1-dioxido-3-oxo-1,2-benzothiazol-2(3H)-yl)-N-{2,2,2-trichloro-1-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)amino]ethyl}acetamide
Smiles: O=C(CN1C(=O)c2c(S1(=O)=O)cccc2)NC(C(Cl)(Cl)Cl)Nc1c(C)n(n(c1=O)c1ccccc1)C

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Molecular Weight: 572.86
Empirical Formula: C22H20Cl3N5O5S

Physical State: Dry powder
Available Amount: 410 mg

Lipinsky:
logP: 2.98
Rotatable bonds: 4
H-donors: 2
H-acceptors: 5
PSA: 127
Number of rings: 4

     

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