| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 2008 | 11 | Yes |
Popular Name: Ethyl 3-(allylamino)propanoate Ethyl 3-(allylamino)propanoate
Find On: PubMed — Wikipedia — Google
CAS Numbers: 44981-87-5 , [44981-87-5]
| 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) | 0.59 | 4.47 | -43.15 | 2 | 3 | 1 | 43 | 158.221 | 7 | ↓ |
| Hi High (pH 8-9.5) | 0.59 | 3.05 | -5.11 | 1 | 3 | 0 | 38 | 157.213 | 7 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
