UCSF

ZINC13143583

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 30th, 2008 29 No

Popular Name: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(diethylaminomethyl)-N-[1-(4-pyridyl)ethylideneamino]triazole-4-c 1-(4-amino-1,2,5-oxadiazol-3-yl)…

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) 0.56 5.24 -32.63 4 12 1 154 399.439 8 ↓
Mid Mid (pH 6-8) 0.56 3.13 -9.65 3 12 0 153 398.431 8 ↓

Activity (Go SEA)

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