UCSF

ZINC63866889

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
June 7th, 2011 9 Yes

Popular Name: 5-Azaindole 5-Azaindole

Find On: PubMed — Wikipedia — Google

CAS Number: 271-34-1

Other Names:

MFCD00955936

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) 0.69 2.48 -98.39 2 2 2 28 120.155 0 ↓
Hi High (pH 8-9.5) 0.69 2.05 -34.38 1 2 1 27 119.147 0 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID US6124306 IBM Patent Data

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

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