COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK058042
Chemical Name: {4-[3-(benzylamino)-4-nitrophenyl]piperazin-1-yl}(2-iodophenyl)methanone
Smiles: [O-][N+](=O)c1ccc(cc1NCc1ccccc1)N1CCN(CC1)C(=O)c1ccccc1I

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Molecular Weight: 542.38
Empirical Formula: C24H23IN4O3

Physical State: Dry powder
Available Amount: 330 mg

Lipinsky:
logP: 5.54
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 81
Number of rings: 4

     

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