COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL392824
Chemical Name: 4-({3-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]phenyl}amino)-4-oxobutanoicacid
Smiles: O=C(Nc1cccc(c1)Cn1nc(c(c1C)Br)C)CCC(=O)O

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Molecular Weight: 380.24
Empirical Formula: C16H18BrN3O3

Physical State: Dry powder
Available Amount: 38 mg

Lipinsky:
logP: 2.493
Rotatable bonds: 6
H-donors: 2
H-acceptors: 3
PSA: 84
Number of rings: 2

     

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