UCSF

ZINC06643328

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 11th, 2006 10 Yes

Popular Name: 5-Amino-7-azaindole 5-Amino-7-azaindole

Find On: PubMed — Wikipedia — Google

CAS Numbers: 100960-07-4 , 1187421-28-8 , [100960-07-4]

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) 0.89 1.67 -7.63 3 3 0 55 133.154 0 ↓
Ref Reference (pH 7) 0.60 1.45 -13.13 2 3 0 51 133.154 0 ↓
Mid Mid (pH 6-8) 0.89 1.91 -27.74 4 3 1 56 134.162 0 ↓
Lo Low (pH 4.5-6) 0.60 1.9 -38.11 3 3 1 53 134.162 0 ↓

Vendor Notes

Note Type Comments Provided By
MP 128-129° Matrix Scientific
Melting_Point 129-131? Alfa-Aesar
Melting_Point 129-131° Alfa-Aesar
Purity 95% Fluorochem
Purity 98% Matrix Scientific
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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

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