COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL407077
Chemical Name: (4Z)-1-(3,4-dichlorophenyl)-4-(4-hydroxy-3-nitrobenzylidene)pyrazolidine-3,5-dione
Smiles: O=C1NN(C(=O)/C/1=C\c1ccc(c(c1)[N+](=O)[O-])O)c1ccc(c(c1)Cl)Cl

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Molecular Weight: 394.17
Empirical Formula: C16H9Cl2N3O5

Physical State: Dry powder
Available Amount: 71 mg

Lipinsky:
logP: 4.1
Rotatable bonds: 2
H-donors: 2
H-acceptors: 5
PSA: 115
Number of rings: 3

     

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