UCSF

ZINC71778749

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 22nd, 2011 17 No

Popular Name: (2R)-2-nitroso-4-oxo-5-phenyl-pentanehydroxamic (2R)-2-nitroso-4-oxo-5-phenyl-pe…

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) 0.16 1.82 -17.83 2 6 0 96 236.227 6 ↓
Hi High (pH 8-9.5) 0.34 0.27 -50.11 1 6 -1 102 235.219 6 ↓
Hi High (pH 8-9.5) 0.16 3.03 -54.96 1 6 -1 99 235.219 6 ↓

Activity (Go SEA)

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

No pre-computed analogs available. Try a structural similarity search.