COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK966134
Chemical Name: 2-{7-[(2-ammonio-3-methylbutanoyl)oxy]-5-methyl-4-oxo-4H-chromen-3-yl}-4-methyl-1,3-thiazol-3-ium
Smiles: CC(C(C(=O)Oc1cc(C)c2c(c1)occ(c2=O)c1scc([nH+]1)C)[NH3+])C

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Saltdata: 2 Cl-
Molecular Weight: 374.46
Empirical Formula: C19H22N2O4S

Available Amount: 0 mg

Lipinsky:
logP: 2.586
Rotatable bonds: 5
H-donors: 4
H-acceptors: 4
PSA: 122
Number of rings: 3

     

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