COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL507721
Chemical Name: (4Z)-4-(3-chloro-4,5-diethoxybenzylidene)-5-hydroxy-2-(4-methylphenyl)-2,4-dihydro-3H-pyrazol-3-one
Smiles: CCOc1cc(/C=C\2/C(=NN(C2=O)c2ccc(cc2)C)O)cc(c1OCC)Cl

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Molecular Weight: 400.86
Empirical Formula: C21H21ClN2O4

Physical State: Dry powder
Available Amount: 93 mg

Lipinsky:
logP: 5.321
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 71
Number of rings: 3

     

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