COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL360977
Chemical Name: 7,7-dimethyl-4-(4-nitrophenyl)-5-oxo-2-thioxo-1,2,3,4,5,6,7,8-octahydroquinoline-3-carbonitrile
Smiles: N#CC1C(=S)NC2=C(C1c1ccc(cc1)[N+](=O)[O-])C(=O)CC(C2)(C)C

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Molecular Weight: 355.42
Empirical Formula: C18H17N3O3S

Available Amount: 0 mg

Lipinsky:
logP: 2.759
Rotatable bonds: 0
H-donors: 1
H-acceptors: 3
PSA: 130
Number of rings: 3

     

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