UCSF

ZINC01152937

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 8th, 2004 33 No

Popular Name: methyl 2-[2-(2-fluorophenyl)-4-hydroxy-3-(4-methylbenzoyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate methyl 2-[2-(2-fluorophenyl)-4-h…

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) 3.99 11.54 -44.77 0 7 -1 100 465.482 6 ↓
Mid Mid (pH 6-8) 3.40 1.38 -18.07 0 7 0 93 466.49 6 ↓

Activity (Go SEA)

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