| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2011 | 22 | Yes |
Popular Name: [4-[(2S)-2-hydroxybutyl]piperazin-1-yl]-[(1S)-indan-1-yl]methanone [4-[(2S)-2-hydroxybutyl]piperazi…
| 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) | 1.65 | 5.06 | -10.37 | 1 | 4 | 0 | 44 | 302.418 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.65 | 7.29 | -48.44 | 2 | 4 | 1 | 45 | 303.426 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
