UCSF

ZINC05764086

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
February 12th, 2006 18 Yes

Popular Name: LS-103851; N-Allyl-2,3-dimethyl-3-(m-hydroxyphenyl)piperidine hydrobromide; Phenol, m-(1-allyl-2,3-dimethyl-3-piperidyl)-, hydrobromide; Piperidine, N-allyl-2,3-dimethyl-3-(m-hydroxyphenyl)-, hydrobromide; m-(1-Allyl-2,3-dimethyl-3-piperidyl)phenol hydrob LS-103851; N-Allyl-2,3-dimethyl-…

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) 3.44 6.87 -34.57 2 2 1 25 246.374 3 ↓
Hi High (pH 8-9.5) 3.44 5.06 -3.14 1 2 0 23 245.366 3 ↓

Activity (Go SEA)

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