COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK810446
Chemical Name: (2E)-3-(3-{4-[(4-chlorobenzyl)oxy]phenyl}-1-phenyl-1H-pyrazol-4-yl)-2-cyano-N-(tetrahydrofuran-2-ylmethyl)prop-2-enamide
Smiles: N#C/C(=C\c1cn(nc1c1ccc(cc1)OCc1ccc(cc1)Cl)c1ccccc1)/C(=O)NCC1CCCO1

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Molecular Weight: 539.03
Empirical Formula: C31H27ClN4O3

Physical State: Dry powder
Available Amount: 101 mg

Lipinsky:
logP: 5.229
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 89
Number of rings: 5

     

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