COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK383534
Chemical Name: (2E,5Z)-5-(3-ethyl-1,3-benzothiazol-2(3H)-ylidene)-2-[5-oxo-1-phenyl-3-(phenylamino)-1,5-dihydro-4H-pyrazol-4-ylidene]-3-(prop-2-en-1-yl)-1,3-thiazolidin-4-one
Smiles: C=CCn1/c(=C\2/C(=NN(C2=O)c2ccccc2)Nc2ccccc2)/s/c(=c/2\sc3c(n2CC)cccc3)/c1=O

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Molecular Weight: 551.69
Empirical Formula: C30H25N5O2S2

Physical State: Dry powder
Available Amount: 29 mg

Lipinsky:
logP: 4.375
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 118
Number of rings: 6

     

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