COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK703471
Chemical Name: (2Z)-2-(1-methyl-1H-benzimidazol-2-yl)-3-{3-[3-methyl-4-(3-methylbutoxy)phenyl]-1-phenyl-1H-pyrazol-4-yl}prop-2-enenitrile
Smiles: N#C/C(=C/c1cn(nc1c1ccc(c(c1)C)OCCC(C)C)c1ccccc1)/c1nc2c(n1C)cccc2

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Molecular Weight: 501.63
Empirical Formula: C32H31N5O

Physical State: Dry powder
Available Amount: 401 mg

Lipinsky:
logP: 8.351
Rotatable bonds: 7
H-donors: 0
H-acceptors: 1
PSA: 68
Number of rings: 5

     

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