COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL295769
Chemical Name: 1-{(E)-[1-(4-fluorophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}-3-(2-hydroxy-5-nitrophenyl)urea
Smiles: O=C(Nc1cc(ccc1O)[N+](=O)[O-])N/C=C/1\C(=NN(C1=O)c1ccc(cc1)F)C

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Molecular Weight: 399.34
Empirical Formula: C18H14FN5O5

Physical State: Dry powder
Available Amount: 190 mg

Lipinsky:
logP: 2.491
Rotatable bonds: 1
H-donors: 3
H-acceptors: 5
PSA: 139
Number of rings: 3

     

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