COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL488147
Chemical Name: 3-{3-(4-nitrophenyl)-4-[(1E)-3-oxobut-1-en-1-yl]-1H-pyrazol-1-yl}propanoicacid
Smiles: OC(=O)CCn1cc(c(n1)c1ccc(cc1)[N+](=O)[O-])/C=C/C(=O)C

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Molecular Weight: 329.31
Empirical Formula: C16H15N3O5

Available Amount: 0 mg

Lipinsky:
logP: 1.451
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 118
Number of rings: 2

     

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