UCSF

ZINC42139373

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 25th, 2010 19 Yes

Popular Name: 5-amino-2-[2-(3-pyridyl)ethylamino]pyridine-3-carboxamide 5-amino-2-[2-(3-pyridyl)ethylami…

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) -0.14 0.51 -11.74 5 6 0 107 257.297 5 ↓
Lo Low (pH 4.5-6) -0.14 0.98 -36.46 6 6 1 108 258.305 5 ↓

Activity (Go SEA)

Rings

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

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