UCSF

ZINC04721811

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 1st, 2006 12 No

Popular Name: 1-nitroso-4-tert-butyl-benzene 1-nitroso-4-tert-butyl-benzene

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) 3.54 1.71 -3.74 0 2 0 29 163.22 2 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP1047701A1; WO1999026582A2; WO1999026954A1 IBM Patent Data

Activity (Go SEA)

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