| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 12th, 2008 | 12 | Yes |
Popular Name: 1-Quinolin-5-yl-methylamine hydrochloride 1-Quinolin-5-yl-methylamine hydr…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1187931-81-2 , 58123-57-2 , [1187931-81-2] , [58123-57-2]
1-Quinolin-5-yl-methylamine, HCl
1-quinolin-5-yl-methylaminehcl
1-Quinolin-5-yl-methylaminehydrochloride
| 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) | 1.38 | 2.78 | -53.17 | 3 | 2 | 1 | 41 | 159.212 | 1 | ↓ |
| Hi High (pH 8-9.5) | 4.29 | 10.49 | -46.65 | 4 | 7 | 1 | 95 | 413.571 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.38 | 3.07 | -98.01 | 4 | 2 | 2 | 42 | 160.22 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| BP | 178° | Oakwood Chemical |
| MP | 54-57° | Oakwood Chemical |
| Purity | 95% | Fluorochem |
| Purity | 95+% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.