COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL506254
Chemical Name: (4E)-4-{[5-(4-methoxy-2-nitrophenyl)furan-2-yl]methylidene}-2-phenyl-5-(trifluoromethyl)-2,4-dihydro-3H-pyrazol-3-one
Smiles: COc1ccc(c(c1)[N+](=O)[O-])c1ccc(o1)/C=C\1/C(=O)N(N=C1C(F)(F)F)c1ccccc1

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Molecular Weight: 457.37
Empirical Formula: C22H14F3N3O5

Physical State: Dry powder
Available Amount: 186 mg

Lipinsky:
logP: 6.642
Rotatable bonds: 3
H-donors: 0
H-acceptors: 5
PSA: 100
Number of rings: 4

     

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