UCSF

ZINC20128166

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 16th, 2008 21 Yes

Popular Name: 1-propyl-N-[2-([1,2,4]triazolo[4,5-a]pyridin-3-yl)ethyl]piperidin-4-amine 1-propyl-N-[2-([1,2,4]triazolo[4…

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) 2.13 8.73 -48.84 2 5 1 47 288.419 6 ↓
Mid Mid (pH 6-8) 2.13 7.67 -57.18 2 5 1 50 288.419 6 ↓
Lo Low (pH 4.5-6) 2.13 10.02 -126.47 3 5 2 51 289.427 6 ↓

Activity (Go SEA)

Rings

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