UCSF

ZINC52533098

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 10th, 2010 19 Yes

Popular Name: 8-[(1R)-1-(2-fluorophenyl)ethyl]-1,4-dioxa-8-azaspiro[4.5]decane 8-[(1R)-1-(2-fluorophenyl)ethyl]…

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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) 2.69 7.75 -32.95 1 3 1 23 266.336 2 ↓
Mid Mid (pH 6-8) 2.69 6.14 -4.79 0 3 0 22 265.328 2 ↓

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

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