COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL295649
Chemical Name: diethyl5-({(E)-[1-(4-chlorophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)-3-methylthiophene-2,4-dicarboxylate
Smiles: CCOC(=O)c1c(N/C=C/2\C(=NN(C2=O)c2ccc(cc2)Cl)C)sc(c1C)C(=O)OCC

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Molecular Weight: 475.95
Empirical Formula: C22H22ClN3O5S

Physical State: Dry powder
Available Amount: 456 mg

Lipinsky:
logP: 6.269
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 125
Number of rings: 3

     

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