COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK383536
Chemical Name: N-[(4E)-4-[(5Z)-3-ethyl-5-(5-methoxy-3-methyl-1,3-benzothiazol-2(3H)-ylidene)-4-oxo-1,3-thiazolidin-2-ylidene]-5-oxo-1-(2,4,6-trichlorophenyl)-4,5-dihydro-1H-pyrazol-3-yl]acetamide
Smiles: COc1ccc2c(c1)n(C)/c(=c\1/s/c(=C/3\C(=NN(C3=O)c3c(Cl)cc(cc3Cl)Cl)NC(=O)C)/n(c1=O)CC)/s2

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Molecular Weight: 624.96
Empirical Formula: C25H20Cl3N5O4S2

Physical State: Dry powder
Available Amount: 90 mg

Lipinsky:
logP: 2.965
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 145
Number of rings: 5

     

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