| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2008 | 31 | Yes |
Popular Name: 2-[4-[(2S)-2-hydroxy-3-isopropoxy-propyl]piperazin-1-yl]ethylBLAHone 2-[4-[(2S)-2-hydroxy-3-isopropox…
| 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) | 1.33 | 6.49 | -45.46 | 2 | 7 | 1 | 61 | 431.601 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.33 | 4.17 | -14.72 | 1 | 7 | 0 | 59 | 430.593 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
