COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK904374
Chemical Name: (2E)-2-cyano-3-{1-phenyl-3-[3-(piperidin-1-ylsulfonyl)phenyl]-1H-pyrazol-4-yl}-N-(tetrahydrofuran-2-ylmethyl)prop-2-enamide
Smiles: N#C/C(=C\c1cn(nc1c1cccc(c1)S(=O)(=O)N1CCCCC1)c1ccccc1)/C(=O)NCC1CCCO1

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Molecular Weight: 545.66
Empirical Formula: C29H31N5O4S

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 3.298
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 125
Number of rings: 5

     

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