COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK383502
Chemical Name: 1-{(4E)-4-[(5Z)-3-ethyl-5-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)-4-oxo-1,3-thiazolidin-2-ylidene]-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-3-yl}-3-octadecylurea
Smiles: CCCCCCCCCCCCCCCCCCNC(=O)NC1=NN(C(=O)/C/1=c\1/s/c(=c/2\sc3c(n2C)cccc3)/c(=O)n1CC)c1ccccc1

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Molecular Weight: 745.07
Empirical Formula: C41H56N6O3S2

Physical State: Dry powder
Available Amount: 130 mg

Lipinsky:
logP: 10.082
Rotatable bonds: 18
H-donors: 2
H-acceptors: 3
PSA: 147
Number of rings: 5

     

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