COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL367237
Chemical Name: 3-methoxy-4-(2-{4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl}-2-oxoethoxy)benzaldehyde
Smiles: O=Cc1ccc(c(c1)OC)OCC(=O)N1CCN(CC1)c1ccc(cc1[N+](=O)[O-])C(F)(F)F

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Molecular Weight: 467.4
Empirical Formula: C21H20F3N3O6

Physical State: Dry powder
Available Amount: 9784 mg

Lipinsky:
logP: 4.035
Rotatable bonds: 5
H-donors: 0
H-acceptors: 6
PSA: 104
Number of rings: 3

     

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