COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL056842
Chemical Name: 4-[(Z)-{3-[3-(diethylammonio)propyl]-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene}methyl]phenolate
Smiles: CC[NH+](CCCN1C(=S)S/C(=C\c2ccc(cc2)[O-])/C1=O)CC

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Molecular Weight: 350.51
Empirical Formula: C17H22N2O2S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.766
Rotatable bonds: 6
H-donors: 1
H-acceptors: 2
PSA: 105
Number of rings: 2

     

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