COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK569682
Chemical Name: 2-[5-(4-nitrophenyl)-4,6-dioxo-2-phenylhexahydro-2H-pyrrolo[3,4-d][1,2]oxazol-3-yl]phenylbenzenesulfonate
Smiles: O=C1C2C(N(OC2C(=O)N1c1ccc(cc1)[N+](=O)[O-])c1ccccc1)c1ccccc1OS(=O)(=O)c1ccccc1

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Molecular Weight: 571.57
Empirical Formula: C29H21N3O8S

Physical State: Dry powder
Available Amount: 308 mg

Lipinsky:
logP: 3.682
Rotatable bonds: 3
H-donors: 0
H-acceptors: 8
PSA: 147
Number of rings: 6

     

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