UCSF

ZINC11819227

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
March 12th, 2008 26 Yes

Popular Name: 5-(azepan-1-yl)-N-[(1-ethylimidazol-2-yl)methyl]-N-methyl-[1,2,5]oxadiazolo[3,4-e]pyrazin-6-amine 5-(azepan-1-yl)-N-[(1-ethylimida…

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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) 2.29 -1.88 -10.06 0 9 0 89 356.434 5 ↓
Mid Mid (pH 6-8) 2.29 -1.67 -36.39 1 9 1 90 357.442 5 ↓

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Rings

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

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