UCSF

ZINC69975218

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2011 16 Yes

Popular Name: 2-[3-[(1R,4S,5R)-7-oxabicyclo[2.2.1]heptan-5-yl]-1,2,4-oxadiazol-5-yl]propan-2-amine 2-[3-[(1R,4S,5R)-7-oxabicyclo[2.…

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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) 0.69 0.04 -45.66 3 5 1 76 224.284 2 ↓
Hi High (pH 8-9.5) 0.69 -0.22 -5.81 2 5 0 74 223.276 2 ↓

Activity (Go SEA)

Rings

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

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