COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK145500
Chemical Name: N-(4-nitrobenzyl)pentan-3-amine
Smiles: CCC(NCc1ccc(cc1)[N+](=O)[O-])CC

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Saltdata: C2H2O4
Molecular Weight: 222.29
Empirical Formula: C12H18N2O2

Physical State: Dry powder
Available Amount: 135 mg

Lipinsky:
logP: 3.19
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 57
Number of rings: 1

     

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