COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK823123
Chemical Name: (2E)-2-[(4-chlorophenyl)sulfonyl]-3-{1-phenyl-3-[4-(prop-2-en-1-yloxy)phenyl]-1H-pyrazol-4-yl}prop-2-enenitrile
Smiles: C=CCOc1ccc(cc1)c1nn(cc1/C=C(/S(=O)(=O)c1ccc(cc1)Cl)\C#N)c1ccccc1

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Molecular Weight: 501.99
Empirical Formula: C27H20ClN3O3S

Physical State: Dry powder
Available Amount: 104 mg

Lipinsky:
logP: 6.517
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 93
Number of rings: 4

     

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