COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK026182
Chemical Name: (4-chlorophenyl){4-[3-(3,4-dihydroisoquinolin-2(1H)-yl)-4-nitrophenyl]piperazin-1-yl}methanone
Smiles: Clc1ccc(cc1)C(=O)N1CCN(CC1)c1ccc(c(c1)N1CCc2c(C1)cccc2)[N+](=O)[O-]

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Molecular Weight: 476.96
Empirical Formula: C26H25ClN4O3

Physical State: Dry powder
Available Amount: 90 mg

Lipinsky:
logP: 5.664
Rotatable bonds: 0
H-donors: 0
H-acceptors: 3
PSA: 72
Number of rings: 5

     

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