COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK673261
Chemical Name: 2-amino-4-(5-bromothiophen-2-yl)-1-[2-chloro-5-(trifluoromethyl)phenyl]-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(c2cc(ccc2Cl)C(F)(F)F)C2=C(C1c1ccc(s1)Br)C(=O)CCC2

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Molecular Weight: 528.78
Empirical Formula: C21H14BrClF3N3OS

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.29
Rotatable bonds: 1
H-donors: 2
H-acceptors: 1
PSA: 98
Number of rings: 4

     

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