COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL420152
Chemical Name: (3-chloro-4-methylphenyl)[4-(4-nitrophenyl)piperazin-1-yl]methanone
Smiles: O=C(c1ccc(c(c1)Cl)C)N1CCN(CC1)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 359.81
Empirical Formula: C18H18ClN3O3

Physical State: Dry powder
Available Amount: 740 mg

Lipinsky:
logP: 3.343
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 69
Number of rings: 3

     

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