COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL278817
Chemical Name: 3-[3-({2-[(2,3-dimethylphenyl)amino]-2-oxoethyl}sulfanyl)-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl]propanoicacid-3-(5-oxo-3-sulfanyl-4,5-dihydro-1,2,4-triazin-6-yl)propanoicacid(1:1)
Smiles: O=C(Nc1cccc(c1C)C)CSc1nnc(c(=O)[nH]1)CCC(=O)O.OC(=O)CCc1nnc([nH]c1=O)S

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Molecular Weight: 563.62
Empirical Formula: C22H25N7O7S2

Available Amount: 0 mg

Lipinsky:
logP: 0
Rotatable bonds: 12
H-donors: 5
H-acceptors: 7
PSA: 275
Number of rings: 3

     

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