COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK472893
Chemical Name: (2E)-3-[1-(2-chloro-4-fluorobenzyl)-3-phenyl-1H-pyrazol-4-yl]-N-(2-chloro-5-nitrophenyl)-2-cyanoprop-2-enamide
Smiles: N#C/C(=C\c1cn(nc1c1ccccc1)Cc1ccc(cc1Cl)F)/C(=O)Nc1cc(ccc1Cl)[N+](=O)[O-]

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Molecular Weight: 536.35
Empirical Formula: C26H16Cl2FN5O3

Physical State: Dry powder
Available Amount: 94 mg

Lipinsky:
logP: 6.011
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 116
Number of rings: 4

     

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