COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK421152
Chemical Name: 2-(4-chloro-2-methylphenoxy)-1-[4-(4-nitrophenyl)piperazin-1-yl]propan-1-one
Smiles: Clc1ccc(c(c1)C)OC(C(=O)N1CCN(CC1)c1ccc(cc1)[N+](=O)[O-])C

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Molecular Weight: 403.87
Empirical Formula: C20H22ClN3O4

Physical State: Dry powder
Available Amount: 1318 mg

Lipinsky:
logP: 4.219
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 78
Number of rings: 3

     

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