COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK756388
Chemical Name: 2-amino-1-(5-bromopyridin-2-yl)-7,7-dimethyl-5-oxo-4-(thiophen-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(C2=C(C1c1cscc1)C(=O)CC(C2)(C)C)c1ccc(cn1)Br

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Molecular Weight: 455.38
Empirical Formula: C21H19BrN4OS

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.765
Rotatable bonds: 1
H-donors: 2
H-acceptors: 1
PSA: 111
Number of rings: 4

     

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