| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 31st, 2011 | 24 | Yes |
Popular Name: [4-[(2R)-2-hydroxypropyl]piperazin-1-yl]-(6-isopropyl-1H-indol-2-yl)methanone [4-[(2R)-2-hydroxypropyl]piperaz…
| 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) | 2.95 | 4.55 | -9.13 | 2 | 5 | 0 | 60 | 329.444 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.95 | 6.84 | -46.87 | 3 | 5 | 1 | 61 | 330.452 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
