COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL383233
Chemical Name: (4Z)-4-{[5-(4,5-dimethyl-2-nitrophenyl)furan-2-yl]methylidene}-2-(4-fluorophenyl)-5-hydroxy-2,4-dihydro-3H-pyrazol-3-one
Smiles: Fc1ccc(cc1)N1N=C(/C(=C/c2ccc(o2)c2cc(C)c(cc2[N+](=O)[O-])C)/C1=O)O

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Molecular Weight: 421.38
Empirical Formula: C22H16FN3O5

Physical State: Dry powder
Available Amount: 227 mg

Lipinsky:
logP: 5.113
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 111
Number of rings: 4

     

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