UCSF

ZINC68949455

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 16th, 2011 15 Yes

Popular Name: (1R)-8-ethyl-3-azaspiro[4.5]decane-1-carboxylic (1R)-8-ethyl-3-azaspiro[4.5]deca…

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Download: MOL2 SDF SMILES Flexibase

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) 2.02 5.94 -54.64 2 3 0 57 211.305 2 ↓
Hi High (pH 8-9.5) 2.02 4.49 -44.19 1 3 -1 52 210.297 2 ↓

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

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