UCSF

ZINC37832754

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 2nd, 2009 19 No

Popular Name: 8-[(2R)-2-bromo-3-methyl-butanoyl]-1,3,8-triazaspiro[4.5]decane-2,4-dione 8-[(2R)-2-bromo-3-methyl-butanoy…

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) 0.59 1.51 -13.76 2 6 0 79 332.198 2 ↓
Hi High (pH 8-9.5) 0.77 -1.13 -44.07 1 6 -1 85 331.19 2 ↓

Activity (Go SEA)

Rings

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