| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 2008 | 28 | Yes |
Popular Name: 3-[[(3S)-4-benzyl-3-(2-hydroxyethyl)piperazin-1-yl]methyl]chromen-4-one 3-[[(3S)-4-benzyl-3-(2-hydroxyet…
| 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) | 2.47 | 7.55 | -42.3 | 2 | 5 | 1 | 58 | 379.48 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.47 | 7.44 | -42.47 | 2 | 5 | 1 | 58 | 379.48 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.47 | 5.21 | -13.88 | 1 | 5 | 0 | 57 | 378.472 | 6 | ↓ |
