COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL571123
Chemical Name: methyl4-{[2-({5-oxo-6-[2-(propanoylamino)phenyl]-2,5-dihydro-1,2,4-triazin-3-yl}sulfanyl)butanoyl]amino}benzoate
Smiles: CCC(=O)Nc1ccccc1c1n[nH]c(nc1=O)SC(C(=O)Nc1ccc(cc1)C(=O)OC)CC

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Molecular Weight: 495.56
Empirical Formula: C24H25N5O5S

Physical State: Dry powder
Available Amount: 156 mg

Lipinsky:
logP: 2.849
Rotatable bonds: 7
H-donors: 3
H-acceptors: 5
PSA: 163
Number of rings: 3

     

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