COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL151057
Chemical Name: (E)-{1-[3-(diethylammonio)propyl]-4,5-dioxo-2-(pyridin-4-yl)pyrrolidin-3-ylidene}(3-methoxyphenyl)methanolate
Smiles: CC[NH+](CCCN1C(=O)C(=O)/C(=C(\c2cccc(c2)OC)/[O-])/C1c1ccncc1)CC

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Molecular Weight: 423.51
Empirical Formula: C24H29N3O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.974
Rotatable bonds: 8
H-donors: 1
H-acceptors: 4
PSA: 87
Number of rings: 3

     

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