COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL431831
Chemical Name: (4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-1-(3-bromophenyl)pyrazolidine-3,5-dione
Smiles: Brc1cccc(c1)N1NC(=O)/C(=C/c2ccc3c(c2)OCO3)/C1=O

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Molecular Weight: 387.19
Empirical Formula: C17H11BrN2O4

Physical State: Dry powder
Available Amount: 118 mg

Lipinsky:
logP: 4.067
Rotatable bonds: 1
H-donors: 1
H-acceptors: 4
PSA: 67
Number of rings: 4

     

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