UCSF

ZINC69660559

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 28th, 2011 16 Yes

Popular Name: (3R)-3-(isopropoxymethyl)-4-oxa-1-azaspiro[5.5]undecane (3R)-3-(isopropoxymethyl)-4-oxa-…

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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) 2.63 5.01 -37.08 2 3 1 35 228.356 3 ↓
Hi High (pH 8-9.5) 2.63 4.19 -3.23 1 3 0 30 227.348 3 ↓

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

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