COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL431907
Chemical Name: (4Z)-1-(3-chloro-4-methylphenyl)-4-(3,4,5-trimethoxybenzylidene)pyrazolidine-3,5-dione
Smiles: COc1c(OC)cc(cc1OC)/C=C\1/C(=O)NN(C1=O)c1ccc(c(c1)Cl)C

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Molecular Weight: 402.83
Empirical Formula: C20H19ClN2O5

Physical State: Dry powder
Available Amount: 80 mg

Lipinsky:
logP: 3.818
Rotatable bonds: 2
H-donors: 1
H-acceptors: 5
PSA: 77
Number of rings: 3

     

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