COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK995589
Chemical Name: 3-methyl-2-{(5Z)-4-oxo-5-[(7-oxo-2,3,6,7-tetrahydro[1,4]dioxino[2,3-g]quinolin-8-yl)methylidene]-2-thioxo-1,3-thiazolidin-3-yl}butanoicacid
Smiles: CC(C(N1C(=S)S/C(=C\c2cc3cc4OCCOc4cc3[nH]c2=O)/C1=O)C(=O)O)C

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Molecular Weight: 446.5
Empirical Formula: C20H18N2O6S2

Available Amount: 0 mg

Lipinsky:
logP: 1.457
Rotatable bonds: 5
H-donors: 2
H-acceptors: 6
PSA: 162
Number of rings: 4

     

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