UCSF

ZINC12416270

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 14th, 2008 32 No

Popular Name: (5S)-5-(3,4-diethoxyphenyl)-1-(3-dimethylaminopropyl)-4-(furan-2-carbonyl)-3-hydroxy-5H-pyrrol-2-one (5S)-5-(3,4-diethoxyphenyl)-1-(3…

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) 2.33 10.26 -78.45 1 8 0 96 442.512 11 ↓
Mid Mid (pH 6-8) 2.78 1.82 -51.88 2 8 1 94 443.52 10 ↓

Activity (Go SEA)

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