COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK865916
Chemical Name: (2Z)-2-(1,3-benzothiazol-2-yl)-3-(1,3-diphenyl-1H-pyrazol-4-yl)prop-2-enenitrile
Smiles: N#C/C(=C/c1cn(nc1c1ccccc1)c1ccccc1)/c1nc2c(s1)cccc2

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Molecular Weight: 404.49
Empirical Formula: C25H16N4S

Physical State: Dry powder
Available Amount: 101 mg

Lipinsky:
logP: 6.845
Rotatable bonds: 2
H-donors: 0
H-acceptors: 0
PSA: 82
Number of rings: 5

     

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