COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL040408
Chemical Name: (E)-{1-[3-(diethylammonio)propyl]-4,5-dioxo-2-(pyridin-3-yl)pyrrolidin-3-ylidene}(2-methylimidazo[1,2-a]pyridin-3-yl)methanolate
Smiles: CC[NH+](CCCN1C(=O)C(=O)/C(=C(\c2c(C)nc3n2cccc3)/[O-])/C1c1cccnc1)CC

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Molecular Weight: 447.54
Empirical Formula: C25H29N5O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.59
Rotatable bonds: 8
H-donors: 1
H-acceptors: 3
PSA: 95
Number of rings: 4

     

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