COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK783995
Chemical Name: 2-amino-1-(3-nitrophenyl)-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(c2cccc(c2)[N+](=O)[O-])C2=C(C1c1scc(c1)Cn1ncnc1)C(=O)CCC2

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Molecular Weight: 473.52
Empirical Formula: C23H19N7O3S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 0.825
Rotatable bonds: 3
H-donors: 2
H-acceptors: 3
PSA: 174
Number of rings: 5

     

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