COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK137666
Chemical Name: (2E)-1-[4-(3-chlorophenyl)piperazin-1-yl]-3-(3-nitrophenyl)-2-phenylprop-2-en-1-one
Smiles: Clc1cccc(c1)N1CCN(CC1)C(=O)/C(=C/c1cccc(c1)[N+](=O)[O-])/c1ccccc1

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Molecular Weight: 447.92
Empirical Formula: C25H22ClN3O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.956
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 69
Number of rings: 4

     

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