UCSF

ZINC37730047

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 30th, 2009 14 Yes

Popular Name: 1-[2-(2-pyridyl)ethyl]-1,2,4-triazol-3-amine 1-[2-(2-pyridyl)ethyl]-1,2,4-tri…

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) -0.10 6.16 -10.51 2 5 0 70 189.222 3 ↓
Lo Low (pH 4.5-6) -0.10 6.51 -39.84 3 5 1 71 190.23 3 ↓

Activity (Go SEA)

Rings

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

No pre-computed analogs available. Try a structural similarity search.