COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK225429
Chemical Name: 1-[4-(4-nitrophenyl)piperazin-1-yl]-2-(2,3,5-trimethylphenoxy)ethanone
Smiles: Cc1cc(OCC(=O)N2CCN(CC2)c2ccc(cc2)[N+](=O)[O-])c(c(c1)C)C

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Molecular Weight: 383.45
Empirical Formula: C21H25N3O4

Physical State: Dry powder
Available Amount: 286 mg

Lipinsky:
logP: 4.106
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 78
Number of rings: 3

     

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