UCSF

ZINC08433261

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 14th, 2006 33 No

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

Find On: PubMed — Wikipedia — Google

Other Names:

MFCD03042794

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 3.54 10.29 -50.77 2 7 1 81 451.543 10 ↓
Mid Mid (pH 6-8) 2.96 11.09 -60.7 1 7 1 77 451.543 10 ↓

Activity (Go SEA)

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