UCSF

ZINC02577877

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 11 Yes

Popular Name: 7-Fluorooxindole 7-Fluorooxindole

Find On: PubMed — Wikipedia — Google

CAS Numbers: 71294-02-6 , 71294-03-6 , [71294-03-6]

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) 1.22 3.01 -7.9 1 2 0 29 151.14 0 ↓
Hi High (pH 8-9.5) 2.18 1.7 -42.58 1 2 -1 39 150.132 0 ↓

Vendor Notes

Note Type Comments Provided By
Purity 97% Fluorochem
PUBCHEM_PATENT_ID WO1999048868A2; WO2000008202A2 IBM Patent Data

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