UCSF

ZINC65529622

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 19th, 2011 25 Yes

Popular Name: (9aS)-8-[[2-(5-methyl-2-furyl)phenyl]methyl]-2,3,6,7,9,9a-hexahydropyrazino[1,2-a]pyrazine-1,4-dione (9aS)-8-[[2-(5-methyl-2-furyl)ph…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.02 3.95 -12.37 1 6 0 66 339.395 3 ↓
Lo Low (pH 4.5-6) 1.02 6.18 -37.69 2 6 1 67 340.403 3 ↓

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Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.