COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK559653
Chemical Name: (E)-{1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxo-2-(pyridin-4-yl)pyrrolidin-3-ylidene}(4-propoxyphenyl)methanolate
Smiles: CCCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccncc1)CCC[NH+]1CCOCC1)/[O-]

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Molecular Weight: 465.55
Empirical Formula: C26H31N3O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.55
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 96
Number of rings: 4

     

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