COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL042735
Chemical Name: 2-ethyl4-methyl5-[3-(3-bromo-5-ethoxy-4-hydroxyphenyl)-4,6-dioxo-2-phenylhexahydro-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)c1ccccc1)c1cc(Br)c(c(c1)OCC)O

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Molecular Weight: 659.51
Empirical Formula: C29H27BrN2O9S

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: 4.508
Rotatable bonds: 9
H-donors: 1
H-acceptors: 9
PSA: 160
Number of rings: 5

     

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