UCSF

ZINC34932907

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 1st, 2009 36 No

Popular Name: (4E,5R)-1-[3-(dimethylamino)propyl]-4-[(3-ethoxyphenyl)-hydroxy-methylene]-5-(3,4,5-trimethoxyphenyl (4E,5R)-1-[3-(dimethylamino)prop…

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) 2.72 9.48 -79.88 1 9 0 102 498.576 12 ↓
Lo Low (pH 4.5-6) 2.72 8.74 -55.85 2 9 1 99 499.584 12 ↓

Activity (Go SEA)

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