UCSF

ZINC41583969

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 21st, 2010 31 Yes

Popular Name: 8-[[(3S,5R)-3,5-dimethyl-1-piperidyl]methyl]-7-hydroxy-3-(4-methoxyphenoxy)-2-methyl-chromen-4-one 8-[[(3S,5R)-3,5-dimethyl-1-piper…

Find On: PubMed — Wikipedia — Google

Download: MOL2 SDF SMILES Flexibase

Annotations

None

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) 5.10 10.82 -49.24 2 6 1 73 424.517 5 ↓
Hi High (pH 8-9.5) 5.10 11.38 -35.2 1 6 0 76 423.509 5 ↓

Activity (Go SEA)

Rings

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