COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK368234
Chemical Name: (2E,5Z)-3-butyl-5-(5-methoxy-3-methyl-1,3-benzothiazol-2(3H)-ylidene)-2-[5-oxo-1-phenyl-3-(phenylamino)-1,5-dihydro-4H-pyrazol-4-ylidene]-1,3-thiazolidin-4-one
Smiles: CCCCn1/c(=C\2/C(=NN(C2=O)c2ccccc2)Nc2ccccc2)/s/c(=c/2\sc3c(n2C)cc(cc3)OC)/c1=O

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Molecular Weight: 583.74
Empirical Formula: C31H29N5O3S2

Physical State: Dry powder
Available Amount: 220 mg

Lipinsky:
logP: 4.342
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 128
Number of rings: 6

     

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