COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK566199
Chemical Name: (E)-(2,4-dimethyl-1,3-thiazol-5-yl)[4,5-dioxo-1-(pyridinium-3-ylmethyl)-2-(3,4,5-trimethoxyphenyl)pyrrolidin-3-ylidene]methanolate
Smiles: COc1c(OC)cc(cc1OC)C1N(Cc2ccc[nH+]c2)C(=O)C(=O)/C/1=C(\c1sc(nc1C)C)/[O-]

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Molecular Weight: 495.56
Empirical Formula: C25H25N3O6S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.179
Rotatable bonds: 5
H-donors: 1
H-acceptors: 6
PSA: 143
Number of rings: 4

     

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