COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK130055
Chemical Name: N-[(6-nitro-1,3-benzodioxol-5-yl)methyl]-2-phenylethanamine
Smiles: [O-][N+](=O)c1cc2OCOc2cc1CNCCc1ccccc1

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Saltdata: C2H2O4
Molecular Weight: 300.31
Empirical Formula: C16H16N2O4

Available Amount: 0 mg

Lipinsky:
logP: 3.577
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 76
Number of rings: 3

     

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