COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK772337
Chemical Name: {4-[5-(azepan-1-yl)-4-fluoro-2-nitrophenyl]piperazin-1-yl}(thiophen-2-yl)methanone
Smiles: [O-][N+](=O)c1cc(F)c(cc1N1CCN(CC1)C(=O)c1cccs1)N1CCCCCC1

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Molecular Weight: 432.52
Empirical Formula: C21H25FN4O3S

Physical State: Dry powder
Available Amount: 61 mg

Lipinsky:
logP: 5.327
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 100
Number of rings: 4

     

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