| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 4th, 2010 | 16 | Yes |
Popular Name: 4-[methyl-[(1S)-1-methyl-2-oxo-2-(prop-2-ynylamino)ethyl]amino]butanoic 4-[methyl-[(1S)-1-methyl-2-oxo-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) | -0.28 | 5.03 | -56.24 | 2 | 5 | 0 | 74 | 226.276 | 7 | ↓ |
| Hi High (pH 8-9.5) | -0.28 | 2.72 | -53.34 | 1 | 5 | -1 | 72 | 225.268 | 7 | ↓ |
| Hi High (pH 8-9.5) | -0.09 | 2.81 | -62.78 | 1 | 5 | -1 | 80 | 225.268 | 7 | ↓ |
