COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL431866
Chemical Name: 2-chloro-5-{(4Z)-4-[3-methoxy-4-(propanoyloxy)benzylidene]-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl}benzoicacid
Smiles: CCC(=O)Oc1ccc(cc1OC)/C=C\1/C(=NN(C1=O)c1ccc(c(c1)C(=O)O)Cl)C

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Molecular Weight: 442.86
Empirical Formula: C22H19ClN2O6

Physical State: Dry powder
Available Amount: 107 mg

Lipinsky:
logP: 2.987
Rotatable bonds: 7
H-donors: 1
H-acceptors: 6
PSA: 105
Number of rings: 3

     

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