| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 15th, 2008 | 16 | Yes |
Popular Name: 2-(Piperidin-4-yl)-1,2,3,4-tetrahydroisoquinoline 2-(Piperidin-4-yl)-1,2,3,4-tetra…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 200413-62-3 , 871113-10-9
2-(4-piperidinyl)-1,2,3,4-tetrahydroisoquinoline dihydrochloride
2-(4-Piperidinyl)-1,2,3,4-tetrahydroisoquinolinedihydrochloride
2-(piperidin-4-yl)-1,2,3,4-tetrahydroisoquinoline dihydrochloride
| 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) | 1.56 | 5.99 | -34.51 | 2 | 2 | 1 | 16 | 217.336 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.56 | 5.11 | -43.03 | 2 | 2 | 1 | 20 | 217.336 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 1.56 | 7.48 | -106.93 | 3 | 2 | 2 | 21 | 218.344 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 326 - 328 | Enamine Building Blocks |
| MP | 326...328 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| PUBCHEM_PATENT_ID | EP1057814A1 | IBM Patent Data |
| Warnings | IRRITANT | Matrix Scientific |
