UCSF

ZINC20171415

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 17th, 2008 33 No

Popular Name: (5S)-4-(4-fluorobenzoyl)-3-hydroxy-5-(2-methoxyphenyl)-1-(3-morpholinopropyl)-5H-pyrrol-2-one (5S)-4-(4-fluorobenzoyl)-3-hydro…

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) 2.70 6.57 -58.43 0 7 -1 82 453.49 8 ↓
Mid Mid (pH 6-8) 2.70 8.89 -76 1 7 0 83 454.498 8 ↓

Activity (Go SEA)

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