COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL150796
Chemical Name: (E)-(5-methyl-1-phenyl-1H-pyrazol-4-yl){1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxo-2-(pyridin-3-yl)pyrrolidin-3-ylidene}methanolate
Smiles: O=C1C(=O)N(C(/C/1=C(/c1cnn(c1C)c1ccccc1)\[O-])c1cccnc1)CC[NH+]1CCOCC1

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Molecular Weight: 473.53
Empirical Formula: C26H27N5O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.775
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 104
Number of rings: 5

     

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