COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK564020
Chemical Name: (E)-{1-[2-(dimethylammonio)ethyl]-4,5-dioxo-2-[4-(prop-2-en-1-yloxy)phenyl]pyrrolidin-3-ylidene}(4-propoxyphenyl)methanolate
Smiles: CCCOc1ccc(cc1)/C(=C\1/C(c2ccc(cc2)OCC=C)N(C(=O)C1=O)CC[NH+](C)C)/[O-]

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Molecular Weight: 464.56
Empirical Formula: C27H32N2O5

Available Amount: 0 mg

Lipinsky:
logP: 5.032
Rotatable bonds: 7
H-donors: 1
H-acceptors: 5
PSA: 83
Number of rings: 3

     

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