| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 1st, 2009 | 22 | Yes |
Popular Name: 3-[4-[(2-isopropyl-5-methyl-phenoxy)methyl]-1-piperidyl]propan-1-amine 3-[4-[(2-isopropyl-5-methyl-phen…
| 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) | 3.29 | 9.4 | -108.72 | 4 | 3 | 2 | 41 | 306.494 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.29 | 9.02 | -36.19 | 3 | 3 | 1 | 40 | 305.486 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.29 | 7.16 | -44.32 | 3 | 3 | 1 | 40 | 305.486 | 7 | ↓ |
