UCSF

ZINC19880427

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 12th, 2008 28 No

Popular Name: 4-benzoyl-1-[2-(dimethylamino)ethyl]-3-hydroxy-5-(2-methoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one 4-benzoyl-1-[2-(dimethylamino)et…

Find On: PubMed — Wikipedia — Google

Other Names:

MFCD02048184

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) 2.42 9.44 -73.75 1 6 0 74 380.444 7 ↓
Hi High (pH 8-9.5) 2.42 6.91 -60.52 0 6 -1 73 379.436 7 ↓
Lo Low (pH 4.5-6) 2.42 8.61 -50.07 2 6 1 71 381.452 7 ↓

Activity (Go SEA)

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