COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK320047
Chemical Name: dimethyl5-({(1Z)-1-[1-(4-methoxyphenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]ethyl}amino)benzene-1,3-dicarboxylate
Smiles: COc1ccc(cc1)N1N=C(/C(=C(/Nc2cc(cc(c2)C(=O)OC)C(=O)OC)\C)/C1=O)C

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Molecular Weight: 437.45
Empirical Formula: C23H23N3O6

Physical State: Dry powder
Available Amount: 328 mg

Lipinsky:
logP: 3.611
Rotatable bonds: 4
H-donors: 1
H-acceptors: 6
PSA: 106
Number of rings: 3

     

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