COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK069176
Chemical Name: 1-{2-[(4-methoxy-1,2,5-oxadiazol-3-yl)oxy]ethyl}-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine
Smiles: COc1nonc1OCCN1CCN(CC1)c1ccc(cc1[N+](=O)[O-])C(F)(F)F

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Saltdata: HCl
Molecular Weight: 417.34
Empirical Formula: C16H18F3N5O5

Physical State: Dry powder
Available Amount: 334 mg

Lipinsky:
logP: 4.209
Rotatable bonds: 4
H-donors: 0
H-acceptors: 5
PSA: 109
Number of rings: 3

     

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