COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL052094
Chemical Name: 4-(4-chlorophenyl)-2-oxo-1,3-benzoxathiol-5-yl3-[(5Z)-4-oxo-5-(thiophen-2-ylmethylidene)-2-thioxo-1,3-thiazolidin-3-yl]propanoate
Smiles: O=C(Oc1ccc2c(c1c1ccc(cc1)Cl)sc(=O)o2)CCN1C(=S)S/C(=C\c2cccs2)/C1=O

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Molecular Weight: 560.1
Empirical Formula: C24H14ClNO5S4

Physical State: Dry powder
Available Amount: 108 mg

Lipinsky:
logP: 5.769
Rotatable bonds: 6
H-donors: 0
H-acceptors: 5
PSA: 183
Number of rings: 5

     

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