COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL084688
Chemical Name: ethyl5-methyl-1-[6-({2-[(4-methylphenyl)amino]-2-oxoethyl}sulfanyl)pyrimidin-4-yl]-1H-pyrazole-4-carboxylate
Smiles: CCOC(=O)c1cnn(c1C)c1ncnc(c1)SCC(=O)Nc1ccc(cc1)C

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Molecular Weight: 411.48
Empirical Formula: C20H21N5O3S

Physical State: Dry powder
Available Amount: 101 mg

Lipinsky:
logP: 4.325
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 124
Number of rings: 3

     

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