UCSF

ZINC08729948

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2007 10 Yes

Popular Name: 3-Chloro-7-azaindole 3-Chloro-7-azaindole

Find On: PubMed — Wikipedia — Google

CAS Numbers: 80235-01-4 , [80235-01-4]

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) 1.87 4.32 -6.28 1 2 0 29 152.584 0 ↓
Lo Low (pH 4.5-6) 1.87 4.57 -32.51 2 2 1 30 153.592 0 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 168 - 170 KeyOrganics
MP 168-170° Matrix Scientific
Purity 95% Fluorochem
Purity >95% 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.