UCSF

ZINC40084745

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
March 23rd, 2010 33 No

Popular Name: (2S)-4-hydroxy-1-[2-(2-hydroxyethoxy)ethyl]-3-(4-isobutoxy-2-methyl-benzoyl)-2-(5-methyl-2-furyl)-2H (2S)-4-hydroxy-1-[2-(2-hydroxyet…

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) 2.67 7.02 -65.54 1 8 -1 112 456.515 11 ↓
Lo Low (pH 4.5-6) 2.67 6.13 -16.91 2 8 0 109 457.523 11 ↓

Activity (Go SEA)

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