COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL368020
Chemical Name: 8-(4-{(Z)-[1-(3-chlorophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}-2-methoxyphenoxy)-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: COc1cc(ccc1Oc1nc2c(n1C)c(=O)n(c(=O)n2C)C)/C=C\1/C(=NN(C1=O)c1cccc(c1)Cl)C

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Molecular Weight: 534.96
Empirical Formula: C26H23ClN6O5

Physical State: Dry powder
Available Amount: 336 mg

Lipinsky:
logP: 3.826
Rotatable bonds: 4
H-donors: 0
H-acceptors: 5
PSA: 109
Number of rings: 5

     

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