UCSF

ZINC55089549

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 11th, 2010 29 Yes

Popular Name: 6-[4-[(3-methyl-2-pyridyl)methyl]piperazin-1-yl]-5-(1-piperidyl)-[1,2,5]oxadiazolo[3,4-b]pyrazine 6-[4-[(3-methyl-2-pyridyl)methyl…

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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) 2.75 8.46 -11.85 0 9 0 87 394.483 4 ↓
Mid Mid (pH 6-8) 2.75 9.15 -42.2 1 9 1 89 395.491 4 ↓

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

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