UCSF

ZINC09307201

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 17th, 2007 33 No

Popular Name: 4-[[4-hydroxy-1-(3-methoxypropyl)-5-oxo-2-(p-tolyl)-2H-pyrrol-3-yl]carbonyl]-N,N-dimethyl-benzenesul 4-[[4-hydroxy-1-(3-methoxypropyl…

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) 2.39 7.36 -45.71 0 8 -1 107 471.555 9 ↓
Mid Mid (pH 6-8) 2.84 6.01 -31.11 1 8 0 104 472.563 8 ↓
Mid Mid (pH 6-8) 1.81 -3.85 -23.5 0 8 0 101 472.563 9 ↓

Activity (Go SEA)

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