| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 23rd, 2011 | 20 | Yes |
Popular Name: benzyl 4-[(2-aminoethyl)amino]piperidine-1-carboxylate dihydrochloride benzyl 4-[(2-aminoethyl)amino]pi…
Find On: PubMed — Wikipedia — Google
CAS Number: 1224698-21-8
benzyl4-[(2-aminoethyl)amino]piperidine-1-carboxylatedihydrochloride
| 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) | 0.77 | 4.64 | -130.83 | 5 | 5 | 2 | 74 | 279.384 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.77 | 4.26 | -46.6 | 4 | 5 | 1 | 72 | 278.376 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.77 | 3.45 | -49.46 | 4 | 5 | 1 | 69 | 278.376 | 6 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 2.120000000000000e+002 - 2.140000000000000e+002 | KeyOrganics |
| melting_point | 212 - 214 | KeyOrganics |
| MP | 212-214° | Matrix Scientific |
| Purity | >95% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.
