COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK783445
Chemical Name: 2-amino-1-(5-methyl-1,2-oxazol-3-yl)-5-oxo-4-[4-(1H-1,2,4-triazol-1-ylmethyl)thiophen-2-yl]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(c2noc(c2)C)C2=C(C1c1scc(c1)Cn1ncnc1)C(=O)CCC2

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Molecular Weight: 433.49
Empirical Formula: C21H19N7O2S

Physical State: Dry powder
Available Amount: 66 mg

Lipinsky:
logP: -0.583
Rotatable bonds: 3
H-donors: 2
H-acceptors: 2
PSA: 155
Number of rings: 5

     

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