COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL442965
Chemical Name: (4Z)-4-(5-benzyl-2-hydroxy-3-nitrobenzylidene)-1-(3-chlorophenyl)pyrazolidine-3,5-dione
Smiles: Clc1cccc(c1)N1NC(=O)/C(=C/c2cc(Cc3ccccc3)cc(c2O)[N+](=O)[O-])/C1=O

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Molecular Weight: 449.85
Empirical Formula: C23H16ClN3O5

Physical State: Dry powder
Available Amount: 344 mg

Lipinsky:
logP: 6.172
Rotatable bonds: 3
H-donors: 2
H-acceptors: 5
PSA: 115
Number of rings: 4

     

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