COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK588730
Chemical Name: (E)-{1-[3-(dimethylammonio)propyl]-2-(4-ethylphenyl)-4,5-dioxopyrrolidin-3-ylidene}[4-(propan-2-yloxy)phenyl]methanolate
Smiles: CCc1ccc(cc1)C1N(CCC[NH+](C)C)C(=O)C(=O)/C/1=C(\c1ccc(cc1)OC(C)C)/[O-]

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Molecular Weight: 450.58
Empirical Formula: C27H34N2O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.243
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 74
Number of rings: 3

     

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