UCSF

ZINC69897291

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 31st, 2011 11 Yes

Popular Name: (1S,3R)-5,5-dimethyl-6-oxaspiro[2.5]octan-1-amine (1S,3R)-5,5-dimethyl-6-oxaspiro[…

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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) 1.10 2.31 -44.17 3 2 1 37 156.249 0 ↓
Hi High (pH 8-9.5) 1.10 1.99 -2 2 2 0 35 155.241 0 ↓

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Rings

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

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