UCSF

ZINC60481478

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
March 26th, 2011 20 No

Popular Name: 8-[(2S)-5-oxopyrrolidine-2-carbonyl]-1,3,8-triazaspiro[4.5]decane-2,4-dione 8-[(2S)-5-oxopyrrolidine-2-carbo…

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) -1.76 -2.3 -22.65 3 8 0 108 280.284 1 ↓
Hi High (pH 8-9.5) -1.58 -4.94 -51.88 2 8 -1 114 279.276 1 ↓

Activity (Go SEA)

Rings

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

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