| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 27th, 2009 | 19 | Yes |
Popular Name: (2S)-2-[4-[(1S)-2-(cyclopropylamino)-1-methyl-2-oxo-ethyl]piperazin-1-yl]propanamide (2S)-2-[4-[(1S)-2-(cyclopropylam…
| 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) | -0.34 | 0.19 | -37.01 | 4 | 6 | 1 | 80 | 269.369 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.34 | -1.96 | -14.66 | 3 | 6 | 0 | 79 | 268.361 | 5 | ↓ |
| Lo Low (pH 4.5-6) | -0.34 | 2.4 | -104.69 | 5 | 6 | 2 | 81 | 270.377 | 5 | ↓ |
| Lo Low (pH 4.5-6) | -0.34 | 0.25 | -36.56 | 4 | 6 | 1 | 80 | 269.369 | 5 | ↓ |
