COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK155695
Chemical Name: 2-[(4-chlorophenyl)sulfanyl]-1-{4-[4-nitro-3-(piperidin-1-yl)phenyl]piperazin-1-yl}ethanone
Smiles: Clc1ccc(cc1)SCC(=O)N1CCN(CC1)c1ccc(c(c1)N1CCCCC1)[N+](=O)[O-]

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Molecular Weight: 475.01
Empirical Formula: C23H27ClN4O3S

Physical State: Dry powder
Available Amount: 72 mg

Lipinsky:
logP: 6.653
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 97
Number of rings: 4

     

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