In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2006 | 10 | Yes |
Popular Name: 3-bromo-1H-pyrrolo[2,3-b]pyridine 3-bromo-1H-pyrrolo[2,3-b]pyridine
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1461713-60-9 , 74420-15-8 , [52488-36-5] , [74420-15-8]
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) | 2.00 | 4.4 | -7.55 | 1 | 2 | 0 | 29 | 197.035 | 0 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
melting_point | 172 - 175 | KeyOrganics |
MP | 172-175° | Matrix Scientific |
MP | 185-189° | Oakwood Chemical |
MP | 240 - 242 | Enamine Building Blocks |
MP | 240...242 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
Purity | 95% | Fluorochem |
Purity | >95% | Matrix Scientific |
Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.