COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL432506
Chemical Name: propan-2-yl4-[(4E)-3-methyl-4-{[5-(2-methyl-5-nitrophenyl)furan-2-yl]methylidene}-5-oxo-4,5-dihydro-1H-pyrazol-1-yl]benzoate
Smiles: CC(OC(=O)c1ccc(cc1)N1N=C(/C(=C\c2ccc(o2)c2cc(ccc2C)[N+](=O)[O-])/C1=O)C)C

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Molecular Weight: 473.49
Empirical Formula: C26H23N3O6

Physical State: Dry powder
Available Amount: 162 mg

Lipinsky:
logP: 5.569
Rotatable bonds: 4
H-donors: 0
H-acceptors: 6
PSA: 117
Number of rings: 4

     

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