COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL386601
Chemical Name: (4Z)-4-[4-(dimethylamino)benzylidene]-2-(3,5-dinitrophenyl)-1,3-oxazol-5(4H)-one
Smiles: O=C1OC(=N/C/1=C\c1ccc(cc1)N(C)C)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-]

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Molecular Weight: 382.33
Empirical Formula: C18H14N4O6

Physical State: Dry powder
Available Amount: 120 mg

Lipinsky:
logP: 3.786
Rotatable bonds: 0
H-donors: 0
H-acceptors: 6
PSA: 133
Number of rings: 3

     

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