| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 27th, 2004 | 17 | Yes |
Popular Name: Boc-threo-beta-methyl-DL-aspartic acid Boc-threo-beta-methyl-DL-asparti…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 159107-42-3 , [159107-42-3]
| 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) | 0.70 | 4.89 | -126.99 | 1 | 7 | -2 | 119 | 245.231 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 0.70 | 2.85 | -57.14 | 2 | 7 | -1 | 116 | 246.239 | 6 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
