COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK524106
Chemical Name: 3-(4-{(E)-2-[4-(dimethylamino)phenyl]ethenyl}pyridinium-1-yl)propane-1-sulfonate
Smiles: CN(c1ccc(cc1)/C=C/c1cc[n+](cc1)CCCS(=O)(=O)[O-])C

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Molecular Weight: 346.45
Empirical Formula: C18H22N2O3S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: -3.053
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 72
Number of rings: 2

     

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