| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 21st, 2011 | 20 | Yes |
Popular Name: (4R)-4-[4-[(1R)-1-methylpropyl]piperazin-1-yl]-1,2,3,4-tetrahydroisoquinoline (4R)-4-[4-[(1R)-1-methylpropyl]p…
| 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) | 2.40 | 7.03 | -96.63 | 3 | 3 | 2 | 24 | 275.44 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.40 | 3.84 | -1.53 | 1 | 3 | 0 | 19 | 273.424 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.40 | 5.66 | -31.75 | 2 | 3 | 1 | 20 | 274.432 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
