COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK557220
Chemical Name: 2-(azepan-1-yl)-6-(4-benzylpiperazin-1-yl)-5-nitropyrimidin-4-amine
Smiles: [O-][N+](=O)c1c(N)nc(nc1N1CCN(CC1)Cc1ccccc1)N1CCCCCC1

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Molecular Weight: 411.51
Empirical Formula: C21H29N7O2

Physical State: Dry powder
Available Amount: 451 mg

Lipinsky:
logP: 6.497
Rotatable bonds: 0
H-donors: 2
H-acceptors: 2
PSA: 107
Number of rings: 4

     

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