| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2008 | 15 | Yes |
Popular Name: N-methyl-N-[(2-piperidin-1-ylpyridin-4-yl)methyl]amine N-methyl-N-[(2-piperidin-1-ylpyr…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 879896-58-9 , [879896-58-9]
| 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 | 5.09 | -44.15 | 2 | 3 | 1 | 33 | 206.313 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.56 | 3.88 | -28.6 | 2 | 3 | 1 | 29 | 206.313 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.56 | 3.59 | -4.1 | 1 | 3 | 0 | 28 | 205.305 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Hazard | C: Corrosive | Acros Organics |
| H phrase | H302: Harmful if swallowed | Acros Organics |
| H phrase | H302: Harmful if swallowed; H314: Causes severe skin burns and eye damage; H318: Causes serious eye damage | Acros Organics |
| P phrase | P301 + P330 + P331: IF SWALLOWED: rinse mouth. Do NOT induce vomiting | Acros Organics |
| P phrase | P301 + P330 + P331: IF SWALLOWED: rinse mouth. Do NOT induce vomiting; P280: Wear eye protection/face protection; P305 + P351 + P338: IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue r | Acros Organics |
| R phrase | R22: Harmful if swallowed. | Acros Organics |
| R phrase | R22: Harmful if swallowed.; R34: Causes burns. | Acros Organics |
| S phrase | S23: Do not breathe gas/fumes/vapour/spray. | Acros Organics |
| S phrase | S23: Do not breathe gas/fumes/vapour/spray.; S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.; S36/37/39: Wear suitable protective clothing, gloves and eye/face protection.; S45: In case of accident or if | Acros Organics |
