COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK244071
Chemical Name: N-[(1Z)-3-(azepan-1-yl)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]acetamide
Smiles: CC(=O)N/C(=C\c1cccc(c1)[N+](=O)[O-])/C(=O)N1CCCCCC1

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Molecular Weight: 331.37
Empirical Formula: C17H21N3O4

Physical State: Dry powder
Available Amount: 157 mg

Lipinsky:
logP: 2.667
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 95
Number of rings: 2

     

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