COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL043505
Chemical Name: 4-[5-(4-chlorophenyl)-2-(3-nitrophenyl)-4,6-dioxohexahydro-2H-pyrrolo[3,4-d][1,2]oxazol-3-yl]phenylbenzenesulfonate
Smiles: Clc1ccc(cc1)N1C(=O)C2C(C1=O)ON(C2c1ccc(cc1)OS(=O)(=O)c1ccccc1)c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 606.01
Empirical Formula: C29H20ClN3O8S

Physical State: Dry powder
Available Amount: 309 mg

Lipinsky:
logP: 4.762
Rotatable bonds: 1
H-donors: 0
H-acceptors: 8
PSA: 147
Number of rings: 6

     

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