| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 2nd, 2009 | 15 | Yes |
Popular Name: (3S)-3-amino-1-(4-prop-2-ynylpiperazin-1-yl)butan-1-one (3S)-3-amino-1-(4-prop-2-ynylpip…
| 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) | 0.41 | 1.45 | -40.61 | 3 | 4 | 1 | 51 | 210.301 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 0.41 | 3.71 | -94.91 | 4 | 4 | 2 | 52 | 211.309 | 3 | ↓ |
