COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL053135
Chemical Name: 2-ethyl4-methyl5-[3-{3-methoxy-4-[(phenylcarbonyl)oxy]phenyl}-2-(3-nitrophenyl)-4,6-dioxohexahydro-5H-pyrrolo[3,4-d][1,2]oxazol-5-yl]-3-methylthiophene-2,4-dicarboxylate
Smiles: CCOC(=O)c1sc(c(c1C)C(=O)OC)N1C(=O)C2C(C1=O)C(N(O2)c1cccc(c1)[N+](=O)[O-])c1ccc(c(c1)OC)OC(=O)c1ccccc1

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Molecular Weight: 715.69
Empirical Formula: C35H29N3O12S

Physical State: Dry powder
Available Amount: 309 mg

Lipinsky:
logP: 4.929
Rotatable bonds: 9
H-donors: 0
H-acceptors: 12
PSA: 212
Number of rings: 6

     

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