COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL149037
Chemical Name: (E)-{1-[2-(diethylammonio)ethyl]-4,5-dioxo-2-phenylpyrrolidin-3-ylidene}(2,4-dimethyl-1,3-thiazol-5-yl)methanolate
Smiles: CC[NH+](CCN1C(=O)C(=O)/C(=C(\c2sc(nc2C)C)/[O-])/C1c1ccccc1)CC

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Molecular Weight: 413.54
Empirical Formula: C22H27N3O3S

Physical State: Dry powder
Available Amount: 306 mg

Lipinsky:
logP: 3.709
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 106
Number of rings: 3

     

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