| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 7th, 2008 | 29 | Yes |
Popular Name: (2S)-1-(4-ethylpiperazin-1-yl)-3-(methylBLAHyl)propan-2-ol (2S)-1-(4-ethylpiperazin-1-yl)-3…
| 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) | 3.15 | 10.06 | -100.24 | 3 | 5 | 2 | 37 | 398.595 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.15 | 5.36 | -7.7 | 1 | 5 | 0 | 35 | 396.579 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.15 | 7.75 | -48.9 | 2 | 5 | 1 | 36 | 397.587 | 5 | ↓ |
