COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL148965
Chemical Name: (E)-[1-(2-methoxyethyl)-4,5-dioxo-2-(pyridinium-3-yl)pyrrolidin-3-ylidene](4-methoxy-2-methylphenyl)methanolate
Smiles: COCCN1C(=O)C(=O)/C(=C(\c2ccc(cc2C)OC)/[O-])/C1c1ccc[nH+]c1

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Molecular Weight: 382.42
Empirical Formula: C21H22N2O5

Physical State: Dry powder
Available Amount: 304 mg

Lipinsky:
logP: 2.072
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 93
Number of rings: 3

     

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