COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK630186
Chemical Name: methyl2-{4,6-dioxo-3-[(E)-2-phenylethenyl]-3a,4,6,6a-tetrahydro-5H-pyrrolo[3,4-d][1,2]oxazol-5-yl}benzoate
Smiles: COC(=O)c1ccccc1N1C(=O)C2C(C1=O)C(=NO2)/C=C/c1ccccc1

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Molecular Weight: 376.37
Empirical Formula: C21H16N2O5

Physical State: Dry powder
Available Amount: 309 mg

Lipinsky:
logP: 2.36
Rotatable bonds: 3
H-donors: 0
H-acceptors: 5
PSA: 85
Number of rings: 4

     

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