COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL148201
Chemical Name: (E)-[5-(ethoxycarbonyl)-2,4-dimethyl-1H-pyrrol-3-yl][2-(2-fluorophenyl)-4,5-dioxo-1-(pyridinium-3-ylmethyl)pyrrolidin-3-ylidene]methanolate
Smiles: CCOC(=O)c1[nH]c(c(c1C)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1F)Cc1ccc[nH+]c1)/[O-])C

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Molecular Weight: 477.49
Empirical Formula: C26H24FN3O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.868
Rotatable bonds: 7
H-donors: 2
H-acceptors: 5
PSA: 116
Number of rings: 4

     

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