COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK975232
Chemical Name: N~2~-[2-(cyclohex-1-en-1-yl)ethyl]-N-(3-nitrophenyl)asparagine
Smiles: O=C(CC(C(=O)O)NCCC1=CCCCC1)Nc1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 361.4
Empirical Formula: C18H23N3O5

Available Amount: 0 mg

Lipinsky:
logP: 4.423
Rotatable bonds: 8
H-donors: 3
H-acceptors: 5
PSA: 124
Number of rings: 2

     

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