COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL148511
Chemical Name: (4Z)-5-hydroxy-4-({5-[3-nitro-4-(piperidin-1-yl)phenyl]furan-2-yl}methylidene)-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: OC1=NN(C(=O)/C/1=C\c1ccc(o1)c1ccc(c(c1)[N+](=O)[O-])N1CCCCC1)c1ccccc1

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Molecular Weight: 458.47
Empirical Formula: C25H22N4O5

Physical State: Dry powder
Available Amount: 585 mg

Lipinsky:
logP: 6.085
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 115
Number of rings: 5

     

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