COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK967593
Chemical Name: 3-[(4Z)-4-(3-ethoxy-4-{2-[(2-methoxyphenyl)amino]-2-oxoethoxy}benzylidene)-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl]benzoicacid
Smiles: CCOc1cc(ccc1OCC(=O)Nc1ccccc1OC)/C=C\1/C(=NN(C1=O)c1cccc(c1)C(=O)O)C

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Molecular Weight: 529.55
Empirical Formula: C29H27N3O7

Physical State: Dry powder
Available Amount: 2 mg

Lipinsky:
logP: 3.841
Rotatable bonds: 9
H-donors: 2
H-acceptors: 7
PSA: 126
Number of rings: 4

     

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