COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL431908
Chemical Name: (4Z)-1-(3-chloro-4-methylphenyl)-4-(4-methyl-3-nitrobenzylidene)pyrazolidine-3,5-dione
Smiles: O=C1NN(C(=O)/C/1=C\c1ccc(c(c1)[N+](=O)[O-])C)c1ccc(c(c1)Cl)C

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Molecular Weight: 371.78
Empirical Formula: C18H14ClN3O4

Physical State: Dry powder
Available Amount: 71 mg

Lipinsky:
logP: 4.589
Rotatable bonds: 1
H-donors: 1
H-acceptors: 4
PSA: 95
Number of rings: 3

     

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