COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK822964
Chemical Name: (2Z)-2-(1,3-benzothiazol-2-yl)-3-[3-(4-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enenitrile
Smiles: N#C/C(=C/c1cn(nc1c1ccc(cc1)C)c1ccccc1)/c1nc2c(s1)cccc2

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Molecular Weight: 418.52
Empirical Formula: C26H18N4S

Physical State: Dry powder
Available Amount: 108 mg

Lipinsky:
logP: 7.305
Rotatable bonds: 2
H-donors: 0
H-acceptors: 0
PSA: 82
Number of rings: 5

     

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