COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK086766
Chemical Name: 4-[({(2Z)-4-oxo-3-(2-phenylethyl)-2-[(2-phenylethyl)imino]-1,3-thiazinan-6-yl}carbonyl)amino]benzoicacid
Smiles: O=C(C1CC(=O)N(/C(=N/CCc2ccccc2)/S1)CCc1ccccc1)Nc1ccc(cc1)C(=O)O

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Molecular Weight: 501.61
Empirical Formula: C28H27N3O4S

Physical State: Dry powder
Available Amount: 434 mg

Lipinsky:
logP: 4.703
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 124
Number of rings: 4

     

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