UCSF

ZINC00001467

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 15th, 2005 21 Yes

Popular Name: Flunixin meglumine Flunixin meglumine

Find On: PubMed — Wikipedia — Google

CAS Numbers: 38677-85-9 , 42461-84-7 , [42461-84-7]

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) 3.80 9.31 -46.14 1 4 -1 65 295.24 4 ↓
Lo Low (pH 4.5-6) 3.80 8.93 -47.13 2 4 0 66 296.248 4 ↓

Vendor Notes

Note Type Comments Provided By
Therapy analgesic, antiinflammatory SMDC Pharmakon
Indications anti-inflammatory KeyOrganics Bioactives
Indications anti-inflammatory, analgesic KeyOrganics Bioactives
Target COX Selleck Chemicals

Activity (Go SEA)

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

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