| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 26th, 2004 | 14 | Yes |
Popular Name: Phenyl-pyridin-4-ylmethyl-amine Phenyl-pyridin-4-ylmethyl-amine
Find On: PubMed — Wikipedia — Google
CAS Numbers: 3034-32-0 , 58088-57-6
| 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 | 5.34 | -4.44 | 1 | 2 | 0 | 25 | 184.242 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.90 | 5.8 | -35.41 | 2 | 2 | 1 | 26 | 185.25 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 102° | Matrix Scientific |
| PUBCHEM_PATENT_ID | EP0189678A1; EP0189678B1; EP0882717A1; US4695352; WO1999065867A1 | IBM Patent Data |
| Warnings | IRRITANT | Matrix Scientific |
