| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 1st, 2009 | 16 | Yes |
Popular Name: (2S)-2-amino-N-[(1S)-1-benzyl-2-hydroxy-ethyl]propanamide (2S)-2-amino-N-[(1S)-1-benzyl-2-…
| 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) | -0.22 | 0.16 | -42.79 | 5 | 4 | 1 | 77 | 223.296 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.22 | -0.17 | -7.17 | 4 | 4 | 0 | 75 | 222.288 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | US4613676; US4719288; US4863903 | IBM Patent Data |
