UCSF

ZINC62838727

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 15th, 2011 21 No

Popular Name: 8-[(2S)-2-amino-2-phenyl-ethyl]-8-azaspiro[4.5]decane-7,9-dione 8-[(2S)-2-amino-2-phenyl-ethyl]-…

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) -0.02 6.94 -37.04 3 4 1 65 287.383 3 ↓
Mid Mid (pH 6-8) -0.02 6.61 -7.89 2 4 0 63 286.375 3 ↓

Activity (Go SEA)

Rings

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

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