COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL565036
Chemical Name: 6-(methylamino)-2,4-bis(2,3,4,6-tetra-O-acetylhexopyranosyl)-1,2,4-triazine-3,5(2H,4H)-dione
Smiles: CNc1nn(C2OC(COC(=O)C)C(C(C2OC(=O)C)OC(=O)C)OC(=O)C)c(=O)n(c1=O)C1OC(COC(=O)C)C(C(C1OC(=O)C)OC(=O)C)OC(=O)C

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Molecular Weight: 802.7
Empirical Formula: C32H42N4O20

Physical State: Liquid
Available Amount: 84 mg

Lipinsky:
logP: 0.291
Rotatable bonds: 20
H-donors: 1
H-acceptors: 20
PSA: 293
Number of rings: 3

     

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