COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL148855
Chemical Name: (E)-{1-[3-(diethylammonio)propyl]-4,5-dioxo-2-[4-(propan-2-yl)phenyl]pyrrolidin-3-ylidene}(5-methylfuran-2-yl)methanolate
Smiles: CC[NH+](CCCN1C(=O)C(=O)/C(=C(\c2ccc(o2)C)/[O-])/C1c1ccc(cc1)C(C)C)CC

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Molecular Weight: 438.57
Empirical Formula: C26H34N2O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.91
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 78
Number of rings: 3

     

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