UCSF

ZINC65539322

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 19th, 2011 24 Yes

Popular Name: 2-(6,9-dioxa-3-azaspiro[4.4]nonan-3-yl)-N-[[(2S)-4-isobutylmorpholin-2-yl]methyl]acetamide 2-(6,9-dioxa-3-azaspiro[4.4]nona…

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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) 0.94 2.94 -34.77 2 7 1 64 342.46 6 ↓
Mid Mid (pH 6-8) 0.94 4.94 -85.05 3 7 2 66 343.468 6 ↓
Mid Mid (pH 6-8) 0.94 0.64 -9.01 1 7 0 63 341.452 6 ↓

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Rings

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

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