COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK569452
Chemical Name: (E)-[4-(2-methylpropoxy)phenyl]{1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxo-2-(pyridin-3-yl)pyrrolidin-3-ylidene}methanolate
Smiles: CC(COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccnc1)CCC[NH+]1CCOCC1)/[O-])C

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Molecular Weight: 479.58
Empirical Formula: C27H33N3O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.897
Rotatable bonds: 7
H-donors: 1
H-acceptors: 5
PSA: 96
Number of rings: 4

     

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