COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK561817
Chemical Name: (E)-{1-[2-(diethylammonio)ethyl]-4,5-dioxo-2-(pyridin-3-yl)pyrrolidin-3-ylidene}(4-methoxyphenyl)methanolate
Smiles: CC[NH+](CCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)OC)/[O-])/C1c1cccnc1)CC

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Molecular Weight: 409.49
Empirical Formula: C23H27N3O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.819
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 87
Number of rings: 3

     

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