COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL046658
Chemical Name: (E)-{1-[3-(diethylammonio)propyl]-2-[4-(methoxycarbonyl)phenyl]-4,5-dioxopyrrolidin-3-ylidene}(2-methylimidazo[1,2-a]pyridin-3-yl)methanolate
Smiles: CC[NH+](CCCN1C(=O)C(=O)/C(=C(\c2c(C)nc3n2cccc3)/[O-])/C1c1ccc(cc1)C(=O)OC)CC

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Molecular Weight: 504.59
Empirical Formula: C28H32N4O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.06
Rotatable bonds: 8
H-donors: 1
H-acceptors: 5
PSA: 108
Number of rings: 4

     

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