In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 3rd, 2006 | 7 | Yes |
Popular Name: 3-Bromo-5-methyl-1H-pyrazole 3-Bromo-5-methyl-1H-pyrazole
Find On: PubMed — Wikipedia — Google
CAS Numbers: 57097-81-1 , 5744-68-3 , [57097-81-1] , [5744-68-3]
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) | 1.47 | 2.03 | -5.19 | 1 | 2 | 0 | 29 | 161.002 | 0 | ↓ |
Mid Mid (pH 6-8) | 1.47 | 2.04 | -3.42 | 1 | 2 | 0 | 29 | 161.002 | 0 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Purity | 95% | Fluorochem |
Purity | 95+% | Matrix Scientific |
Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.