| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 2008 | 16 | Yes |
Popular Name: Ethyl 3-[(1-phenylethyl)amino]propanoate Ethyl 3-[(1-phenylethyl)amino]pr…
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CAS Numbers: 59576-44-2 , [59576-44-2]
b-alanine, N-(1-phenylethyl)-, ethyl ester
ethyl3-[(1-phenylethyl)amino]propanoate
| 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) | 2.26 | 7.65 | -45.52 | 2 | 3 | 1 | 43 | 222.308 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.26 | 6.4 | -6.09 | 1 | 3 | 0 | 38 | 221.3 | 7 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
