UCSF

ZINC04818243

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 6th, 2006 28 No

Popular Name: 1-(3-aminopropyl)-5-(2-chlorophenyl)-3-hydroxy-4-(4-methoxybenzoyl)-5H-pyrrol-2-one 1-(3-aminopropyl)-5-(2-chlorophe…

Find On: PubMed — Wikipedia — Google

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) 2.14 5.55 -57.67 4 6 1 94 401.87 7 ↓
Mid Mid (pH 6-8) 1.56 6.26 -64.2 3 6 1 91 401.87 7 ↓

Activity (Go SEA)

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