COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL226698
Chemical Name: methyl2-({(E)-[1-(1,1-dioxidotetrahydrothiophen-3-yl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)-4,5-dimethoxybenzoate
Smiles: COC(=O)c1cc(OC)c(cc1N/C=C/1\C(=NN(C1=O)C1CCS(=O)(=O)C1)C)OC

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Molecular Weight: 437.47
Empirical Formula: C19H23N3O7S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.691
Rotatable bonds: 5
H-donors: 1
H-acceptors: 7
PSA: 131
Number of rings: 3

     

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