COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK148637
Chemical Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-nitro-5-(piperidin-1-yl)aniline
Smiles: COc1ccc(cc1OC)CCNc1cc(ccc1[N+](=O)[O-])N1CCCCC1

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Molecular Weight: 385.46
Empirical Formula: C21H27N3O4

Physical State: Dry powder
Available Amount: 365 mg

Lipinsky:
logP: 6.1
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 79
Number of rings: 3

     

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