UCSF

ZINC06524495

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 5th, 2006 10 Yes

Popular Name: 5-Chloropyrazine-2-carboxylic acid 5-Chloropyrazine-2-carboxylic acid

Find On: PubMed — Wikipedia — Google

CAS Numbers: 36070-80-1 , 6531-04-0 , [36070-80-1]

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) 0.84 0.87 -43.24 0 4 -1 66 157.536 1 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 150-160? Alfa-Aesar
Melting_Point 150-160° Alfa-Aesar
MP 157-160° (dec.) Oakwood Chemical
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Matrix Scientific
Warnings IRRITANT Matrix Scientific
Warnings Irritant/Store in Freezer Matrix Scientific

Activity (Go SEA)

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

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