COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK661969
Chemical Name: 2-chloro-5-[(4Z)-4-(4-hydroxy-3-iodo-5-methoxybenzylidene)-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl]benzoicacid
Smiles: COc1cc(/C=C\2/C(=NN(C2=O)c2ccc(c(c2)C(=O)O)Cl)C)cc(c1O)I

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Molecular Weight: 512.69
Empirical Formula: C19H14ClIN2O5

Physical State: Dry powder
Available Amount: 281 mg

Lipinsky:
logP: 3.312
Rotatable bonds: 5
H-donors: 2
H-acceptors: 5
PSA: 99
Number of rings: 3

     

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