| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 2008 | 10 | Yes |
Popular Name: Methyl 3-(propylamino)propanoate Methyl 3-(propylamino)propanoate
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CAS Numbers: 5036-62-4 , [5036-62-4]
b-alanine, N-propyl-, methyl ester
methyl3-(propylamino)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) | 0.45 | 3.75 | -44.07 | 2 | 3 | 1 | 43 | 146.21 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.45 | 2.33 | -5.13 | 1 | 3 | 0 | 38 | 145.202 | 6 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
