UCSF

ZINC19928397

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 13th, 2008 37 No

Popular Name: 3-(4-amino-1,2,5-oxadiazol-3-yl)-N-[[4-(2-amino-2-oxo-ethoxy)-3-ethoxy-phenyl]methyleneamino]-5-(mor 3-(4-amino-1,2,5-oxadiazol-3-yl)…

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) -0.22 0.18 -29.39 5 16 0 211 514.503 11 ↓
Mid Mid (pH 6-8) -0.22 2.51 -66.66 6 16 1 212 515.511 11 ↓

Activity (Go SEA)

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