COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK396372
Chemical Name: 3-{2-[(1Z)-2-(methylsulfanyl)prop-1-en-1-yl]naphtho[1,2-d][1,3]thiazol-1-ium-1-yl}propane-1-sulfonate
Smiles: CS/C(=C\c1sc2c([n+]1CCCS(=O)(=O)[O-])c1ccccc1cc2)/C

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Molecular Weight: 393.55
Empirical Formula: C18H19NO3S3

Physical State: Dry powder
Available Amount: 114 mg

Lipinsky:
logP: 0
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 123
Number of rings: 3

     

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