COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK561367
Chemical Name: 2-{(3E,4E)-4-[(4-chlorophenyl)imino]-3-[hydroxy(phenyl)methylidene]-1,1-dioxido-3,4-dihydro-2H-1,2-benzothiazin-2-yl}-1-(4-nitrophenyl)ethanone
Smiles: Clc1ccc(cc1)/N=C\1/C(=C(/c2ccccc2)\O)/N(CC(=O)c2ccc(cc2)[N+](=O)[O-])S(=O)(=O)c2c1cccc2

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Molecular Weight: 574.01
Empirical Formula: C29H20ClN3O6S

Physical State: Dry powder
Available Amount: 307 mg

Lipinsky:
logP: 7.927
Rotatable bonds: 3
H-donors: 1
H-acceptors: 6
PSA: 141
Number of rings: 5

     

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