COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK674914
Chemical Name: 2-{4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl}ethyl3,4-dimethoxybenzoate
Smiles: COc1ccc(cc1OC)C(=O)OCCN1CCN(CC1)c1ccc(cc1[N+](=O)[O-])C(F)(F)F

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Molecular Weight: 483.44
Empirical Formula: C22H24F3N3O6

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 6.238
Rotatable bonds: 6
H-donors: 0
H-acceptors: 6
PSA: 97
Number of rings: 3

     

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