COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK955835
Chemical Name: 2-amino-5-oxo-4-(3-phenyl-1H-pyrazol-4-yl)-1-[3-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(c2cccc(c2)C(F)(F)F)C2=C(C1c1c[nH]nc1c1ccccc1)C(=O)CCC2

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Molecular Weight: 475.47
Empirical Formula: C26H20F3N5O

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.1
Rotatable bonds: 1
H-donors: 3
H-acceptors: 1
PSA: 98
Number of rings: 5

     

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