| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 29th, 2009 | 16 | Yes |
Popular Name: 1-{1H-pyrrolo[2,3-b]pyridin-3-ylmethyl}piperidine 1-{1H-pyrrolo[2,3-b]pyridin-3-yl…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 23616-64-0 , [23616-64-0]
| 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) | 1.90 | 7.36 | -39.42 | 2 | 3 | 1 | 33 | 216.308 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.90 | 5.14 | -6.36 | 1 | 3 | 0 | 32 | 215.3 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 142 - 143 | KeyOrganics |
| MP | 142-143° | Matrix Scientific |
| Purity | 97% | Matrix Scientific |
| Purity | >95% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
