COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL528478
Chemical Name: (E)-{1-[2-(dimethylammonio)ethyl]-4,5-dioxo-2-(pyridin-3-yl)pyrrolidin-3-ylidene}[2-methyl-4-(2-methylpropoxy)phenyl]methanolate
Smiles: CC(COc1ccc(c(c1)C)/C(=C/1\C(=O)C(=O)N(C1c1cccnc1)CC[NH+](C)C)/[O-])C

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Molecular Weight: 437.54
Empirical Formula: C25H31N3O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.627
Rotatable bonds: 8
H-donors: 1
H-acceptors: 4
PSA: 87
Number of rings: 3

     

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