COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL430972
Chemical Name: methyl4-{(Z)-[1-(4-chlorophenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl}benzoate
Smiles: COC(=O)c1ccc(cc1)/C=C\1/C(=O)NN(C1=O)c1ccc(cc1)Cl

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Molecular Weight: 356.77
Empirical Formula: C18H13ClN2O4

Physical State: Dry powder
Available Amount: 101 mg

Lipinsky:
logP: 3.746
Rotatable bonds: 1
H-donors: 1
H-acceptors: 4
PSA: 75
Number of rings: 3

     

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