COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK823517
Chemical Name: (2Z)-3-{3-[3-methyl-4-(prop-2-en-1-yloxy)phenyl]-1-phenyl-1H-pyrazol-4-yl}-2-(phenylsulfonyl)prop-2-enenitrile
Smiles: C=CCOc1ccc(cc1C)c1nn(cc1/C=C(\S(=O)(=O)c1ccccc1)/C#N)c1ccccc1

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Molecular Weight: 481.58
Empirical Formula: C28H23N3O3S

Physical State: Dry powder
Available Amount: 101 mg

Lipinsky:
logP: 6.12
Rotatable bonds: 6
H-donors: 0
H-acceptors: 3
PSA: 93
Number of rings: 4

     

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