COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK567911
Chemical Name: (E)-[4-(benzyloxy)phenyl]{1-[2-(dimethylammonio)ethyl]-4,5-dioxo-2-(thiophen-2-yl)pyrrolidin-3-ylidene}methanolate
Smiles: C[NH+](CCN1C(c2cccs2)/C(=C(/c2ccc(cc2)OCc2ccccc2)\[O-])/C(=O)C1=O)C

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Molecular Weight: 462.57
Empirical Formula: C26H26N2O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.582
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 102
Number of rings: 4

     

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