| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 23 | Yes |
Popular Name: (2S)-2-[4-[2-(isopropylamino)-2-oxo-ethyl]piperazin-1-yl]-N-[(1S)-1-methylbutyl]propanamide (2S)-2-[4-[2-(isopropylamino)-2-…
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| 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) | 1.72 | 4.51 | -35.66 | 3 | 6 | 1 | 66 | 327.493 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.72 | 4.46 | -40.92 | 3 | 6 | 1 | 66 | 327.493 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.72 | 2.27 | -13.94 | 2 | 6 | 0 | 65 | 326.485 | 8 | ↓ |
