UCSF

ZINC09360767

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 23rd, 2007 33 No

Popular Name: 5-(2,4-dimethoxyphenyl)-4-[hydroxy-(4-isopropoxyphenyl)-methylene]-1-(2-methoxyethyl)pyrrolidine-2,3 5-(2,4-dimethoxyphenyl)-4-[hydro…

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) 3.20 6.71 -62.93 0 8 -1 97 454.499 10 ↓
Mid Mid (pH 6-8) 3.65 6.93 -13.92 1 8 0 95 455.507 9 ↓
Mid Mid (pH 6-8) 2.62 0.1 -14.33 0 8 0 91 455.507 10 ↓

Activity (Go SEA)

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