COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL150662
Chemical Name: (E)-{1-[2-(diethylammonio)ethyl]-4,5-dioxo-2-(3,4,5-trimethoxyphenyl)pyrrolidin-3-ylidene}(2,4-dimethyl-1,3-thiazol-5-yl)methanolate
Smiles: CC[NH+](CCN1C(=O)C(=O)/C(=C(\c2sc(nc2C)C)/[O-])/C1c1cc(OC)c(c(c1)OC)OC)CC

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Molecular Weight: 503.62
Empirical Formula: C25H33N3O6S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.149
Rotatable bonds: 8
H-donors: 1
H-acceptors: 6
PSA: 133
Number of rings: 3

     

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