UCSF

ZINC46672308

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 15th, 2010 27 No

Popular Name: N-[(4R)-4-ethyl-4-methyl-2,5-dioxo-imidazolidin-1-yl]-2-[3-(4-fluorophenoxy)propyl-methyl-amino]acet N-[(4R)-4-ethyl-4-methyl-2,5-dio…

Find On: PubMed — Wikipedia — Google

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

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) 1.71 5.84 -53.46 3 8 1 92 381.428 9 ↓
Hi High (pH 8-9.5) 1.90 4.71 -45.52 2 8 0 98 380.42 9 ↓
Hi High (pH 8-9.5) 1.71 3.58 -18.71 2 8 0 91 380.42 9 ↓

Activity (Go SEA)

Rings

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

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