COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK878260
Chemical Name: (2Z)-2-(azepan-1-ylcarbonyl)-3-(4-nitrophenyl)prop-2-enenitrile
Smiles: N#C/C(=C/c1ccc(cc1)[N+](=O)[O-])/C(=O)N1CCCCCC1

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Molecular Weight: 299.33
Empirical Formula: C16H17N3O3

Physical State: Dry powder
Available Amount: 94 mg

Lipinsky:
logP: 2.735
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 89
Number of rings: 2

     

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