COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK810447
Chemical Name: (2E)-2-cyano-3-(3-{4-[(2-fluorobenzyl)oxy]phenyl}-1-phenyl-1H-pyrazol-4-yl)-N-(tetrahydrofuran-2-ylmethyl)prop-2-enamide
Smiles: N#C/C(=C\c1cn(nc1c1ccc(cc1)OCc1ccccc1F)c1ccccc1)/C(=O)NCC1CCCO1

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Molecular Weight: 522.58
Empirical Formula: C31H27FN4O3

Physical State: Dry powder
Available Amount: 103 mg

Lipinsky:
logP: 4.685
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 89
Number of rings: 5

     

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