| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 2nd, 2009 | 20 | Yes |
Popular Name: (2S)-2-amino-N-ethyl-N-[(1S)-1-(3-hydroxyphenyl)ethyl]butanediamide (2S)-2-amino-N-ethyl-N-[(1S)-1-(…
| 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) | 0.58 | -0.77 | -41.41 | 6 | 6 | 1 | 111 | 280.348 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.58 | -1.13 | -12.09 | 5 | 6 | 0 | 110 | 279.34 | 6 | ↓ |
