COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK566657
Chemical Name: (E)-{1-[3-(dimethylammonio)propyl]-2-(4-methylphenyl)-4,5-dioxopyrrolidin-3-ylidene}(thiophen-2-yl)methanolate
Smiles: Cc1ccc(cc1)C1/C(=C(/c2cccs2)\[O-])/C(=O)C(=O)N1CCC[NH+](C)C

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Molecular Weight: 384.5
Empirical Formula: C21H24N2O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.703
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 93
Number of rings: 3

     

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