UCSF

ZINC02796950

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 3rd, 2004 34 No

Popular Name: 4-(3-bromo-5-ethoxy-4-hydroxy-phenyl)-1-p-anisyl-4H-pyridine-3,5-dicarboxylic-acid-dimethyl-ester 4-(3-bromo-5-ethoxy-4-hydroxy-ph…

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) 4.36 11.13 -15.19 1 8 0 95 532.387 10 ↓
Hi High (pH 8-9.5) 4.36 12.05 -54.65 0 8 -1 97 531.379 10 ↓

Activity (Go SEA)

Rings

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

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