UCSF

ZINC55099455

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 11th, 2010 26 Yes

Popular Name: 7-chloro-N-ethyl-4-hydroxy-N-[[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]quinoline-3-carboxamide 7-chloro-N-ethyl-4-hydroxy-N-[[3…

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) 0.08 4.27 -22.9 1 8 0 101 376.8 6 ↓
Hi High (pH 8-9.5) 1.38 2.76 -46.95 0 8 -1 104 375.792 6 ↓

Activity (Go SEA)

Rings

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

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