COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL037223
Chemical Name: 4-[5-(4-bromophenyl)-2-(3-nitrophenyl)-4,6-dioxohexahydro-2H-pyrrolo[3,4-d][1,2]oxazol-3-yl]-2-methoxyphenylbenzoate
Smiles: COc1cc(ccc1OC(=O)c1ccccc1)C1N(OC2C1C(=O)N(C2=O)c1ccc(cc1)Br)c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 644.44
Empirical Formula: C31H22BrN3O8

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 4.912
Rotatable bonds: 4
H-donors: 0
H-acceptors: 8
PSA: 131
Number of rings: 6

     

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