COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL432795
Chemical Name: ethyl4-[(4E)-4-(4-hydroxy-3,5-dimethoxybenzylidene)-3,5-dioxopyrazolidin-1-yl]benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1NC(=O)/C(=C\c2cc(OC)c(c(c2)OC)O)/C1=O

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Molecular Weight: 412.4
Empirical Formula: C21H20N2O7

Physical State: Dry powder
Available Amount: 86 mg

Lipinsky:
logP: 2.556
Rotatable bonds: 5
H-donors: 2
H-acceptors: 7
PSA: 114
Number of rings: 3

     

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