COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK514688
Chemical Name: 5-[(Z)-{3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene}methyl]-6-[4-(4-fluorophenyl)piperazin-1-yl]-1,4-dimethyl-2-oxo-1,2-dihydropyridine-3-carbonitrile
Smiles: N#Cc1c(C)c(/C=C/2\SC(=S)N(C2=O)CCc2ccc(c(c2)OC)OC)c(n(c1=O)C)N1CCN(CC1)c1ccc(cc1)F

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Molecular Weight: 633.77
Empirical Formula: C32H32FN5O4S2

Physical State: Dry powder
Available Amount: 102 mg

Lipinsky:
logP: 2.768
Rotatable bonds: 6
H-donors: 0
H-acceptors: 4
PSA: 146
Number of rings: 5

     

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