COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL431853
Chemical Name: (4Z)-1-(4-bromophenyl)-4-(2,4-dichloro-5-nitrobenzylidene)pyrazolidine-3,5-dione
Smiles: Brc1ccc(cc1)N1NC(=O)/C(=C/c2cc([N+](=O)[O-])c(cc2Cl)Cl)/C1=O

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Molecular Weight: 457.07
Empirical Formula: C16H8BrCl2N3O4

Available Amount: 0 mg

Lipinsky:
logP: 4.609
Rotatable bonds: 1
H-donors: 1
H-acceptors: 4
PSA: 95
Number of rings: 3

     

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