COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK473381
Chemical Name: (2E)-3-{3-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl}-N-(5-chloro-2-methoxyphenyl)-2-cyanoprop-2-enamide
Smiles: N#C/C(=C\c1ccc(c(c1)Cn1nc(c(c1C)Br)C)OC)/C(=O)Nc1cc(Cl)ccc1OC

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Molecular Weight: 529.82
Empirical Formula: C24H22BrClN4O3

Physical State: Dry powder
Available Amount: 406 mg

Lipinsky:
logP: 5.832
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 89
Number of rings: 3

     

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