COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK017749
Chemical Name: 4-({(1E)-1-[1-(1,3-benzothiazol-2-yl)-5-oxo-3-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene]ethyl}amino)-N-(1,3-thiazol-2-yl)benzenesulfonamide
Smiles: C/C(=C\1/C(=NN(C1=O)c1nc2c(s1)cccc2)c1ccccc1)/Nc1ccc(cc1)S(=O)(=O)Nc1nccs1

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Molecular Weight: 572.69
Empirical Formula: C27H20N6O3S3

Physical State: Dry powder
Available Amount: 341 mg

Lipinsky:
logP: 5.13
Rotatable bonds: 0
H-donors: 2
H-acceptors: 3
PSA: 181
Number of rings: 6

     

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