UCSF

ZINC41533085

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 20th, 2010 34 No

Popular Name: (2S)-2-(2,5-dimethoxyphenyl)-3-[(E)-3-(2-furyl)prop-2-enoyl]-4-hydroxy-1-[2-(1-piperidyl)ethyl]-2H-p (2S)-2-(2,5-dimethoxyphenyl)-3-[…

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) 2.81 11.35 -57.93 1 8 0 96 466.534 9 ↓
Lo Low (pH 4.5-6) 2.81 10.6 -41.51 2 8 1 94 467.542 9 ↓

Activity (Go SEA)

Rings

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