UCSF

ZINC62959935

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 20th, 2011 18 Yes

Popular Name: 8-[[(2S,4R)-4-methoxypyrrolidin-2-yl]methyl]-8-azaspiro[4.5]decane 8-[[(2S,4R)-4-methoxypyrrolidin-…

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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) 2.10 5.62 -34.21 2 3 1 26 253.41 3 ↓
Mid Mid (pH 6-8) 2.10 6.97 -119.09 3 3 2 30 254.418 3 ↓

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Rings

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

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