COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK514873
Chemical Name: (2Z)-3-[3-(4-butoxy-3-fluorophenyl)-1-phenyl-1H-pyrazol-4-yl]-2-[(4-methylphenyl)sulfonyl]prop-2-enenitrile
Smiles: CCCCOc1ccc(cc1F)c1nn(cc1/C=C(\S(=O)(=O)c1ccc(cc1)C)/C#N)c1ccccc1

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Molecular Weight: 515.61
Empirical Formula: C29H26FN3O3S

Physical State: Dry powder
Available Amount: 105 mg

Lipinsky:
logP: 6.882
Rotatable bonds: 7
H-donors: 0
H-acceptors: 3
PSA: 93
Number of rings: 4

     

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