UCSF

ZINC62954136

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 20th, 2011 15 Yes

Popular Name: 8-[(3R)-pyrrolidin-3-yl]-8-azaspiro[4.5]decane 8-[(3R)-pyrrolidin-3-yl]-8-azasp…

Find On: PubMed — Wikipedia — Google

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) 2.13 5.38 -32.88 2 2 1 16 209.357 1 ↓
Hi High (pH 8-9.5) 2.13 4.42 -37.78 2 2 1 20 209.357 1 ↓
Hi High (pH 8-9.5) 2.13 3.2 -0.64 1 2 0 15 208.349 1 ↓
Lo Low (pH 4.5-6) 2.13 6.81 -109.91 3 2 2 21 210.365 1 ↓

Activity (Go SEA)

Rings

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

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