UCSF

ZINC40020244

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
March 21st, 2010 38 No

Popular Name: (2S)-1-[3-(dibutylamino)propyl]-3-(3-ethoxybenzoyl)-2-(4-ethylphenyl)-4-hydroxy-2H-pyrrol-5-one (2S)-1-[3-(dibutylamino)propyl]-…

Find On: PubMed — Wikipedia — Google

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

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) 6.88 16.18 -75.65 1 6 0 74 520.714 16 ↓
Lo Low (pH 4.5-6) 6.88 15.33 -48.95 2 6 1 71 521.722 16 ↓

Activity (Go SEA)

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