UCSF

ZINC17159501

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 16th, 2008 34 No

Popular Name: (4E,5R)-4-[(4-ethoxyphenyl)-hydroxy-methylene]-1-(2-methoxyethyl)-5-(3,4,5-trimethoxyphenyl)pyrrolid (4E,5R)-4-[(4-ethoxyphenyl)-hydr…

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) 2.43 6.6 -62.49 0 9 -1 107 470.498 11 ↓
Mid Mid (pH 6-8) 2.43 6.93 -15.28 1 9 0 104 471.506 11 ↓
Mid Mid (pH 6-8) 1.84 7.32 -13.65 0 9 0 101 471.506 11 ↓

Activity (Go SEA)

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