COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK045697
Chemical Name: (4-benzylpiperazin-1-yl)(2-chloro-4-nitrophenyl)methanone
Smiles: Clc1cc(ccc1C(=O)N1CCN(CC1)Cc1ccccc1)[N+](=O)[O-]

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Molecular Weight: 359.81
Empirical Formula: C18H18ClN3O3

Physical State: Dry powder
Available Amount: 1271 mg

Lipinsky:
logP: 3.049
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 69
Number of rings: 3

     

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