COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL269854
Chemical Name: 3-[3-({2-[(3,4-dimethoxyphenyl)amino]-2-oxoethyl}sulfanyl)-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl]propanoicacid
Smiles: COc1cc(ccc1OC)NC(=O)CSc1nnc(c(=O)[nH]1)CCC(=O)O

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Molecular Weight: 394.41
Empirical Formula: C16H18N4O6S

Available Amount: 0 mg

Lipinsky:
logP: 0.008
Rotatable bonds: 9
H-donors: 3
H-acceptors: 6
PSA: 163
Number of rings: 2

     

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