COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK686939
Chemical Name: 2-amino-4-[4-(1H-benzimidazol-1-ylmethyl)thiophen-2-yl]-5-oxo-1-[2-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(C2=C(C1c1scc(c1)Cn1cnc3c1cccc3)C(=O)CCC2)c1ccccc1C(F)(F)F

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Molecular Weight: 545.59
Empirical Formula: C29H22F3N5OS

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.793
Rotatable bonds: 3
H-donors: 2
H-acceptors: 1
PSA: 116
Number of rings: 6

     

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