| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 2nd, 2011 | 23 | Yes |
Popular Name: [4-[(2S)-2-hydroxybutyl]piperazin-1-yl]-(1-methylindol-2-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) | 2.03 | 4.49 | -9.7 | 1 | 5 | 0 | 49 | 315.417 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.03 | 6.77 | -46.9 | 2 | 5 | 1 | 50 | 316.425 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
