UCSF

ZINC40124625

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
March 24th, 2010 27 No

Popular Name: (2R)-2-(2-chloro-6-fluoro-phenyl)-3-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-4-hydroxy-1,2-dihydrop (2R)-2-(2-chloro-6-fluoro-phenyl…

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) 2.39 4.51 -58.02 1 6 -1 88 388.758 3 ↓
Lo Low (pH 4.5-6) 2.39 3.75 -14.28 2 6 0 85 389.766 3 ↓

Activity (Go SEA)

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