| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 12th, 2011 | 18 | Yes |
Popular Name: (3S)-3-amino-4-[2-carboxyethyl(isobutyl)amino]-4-oxo-butanoic (3S)-3-amino-4-[2-carboxyethyl(i…
None
| 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) | -1.32 | 4.18 | -68.5 | 3 | 7 | -1 | 128 | 259.282 | 8 | ↓ |
| Mid Mid (pH 6-8) | -1.32 | 3.85 | -94.1 | 2 | 7 | -2 | 127 | 258.274 | 8 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | US5354738 | IBM Patent Data |
