| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 8th, 2010 | 22 | Yes |
Popular Name: 1-[4-[(4-isopropylphenyl)methyl]piperazin-1-yl]-3-methyl-butan-1-one 1-[4-[(4-isopropylphenyl)methyl]…
| 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) | 4.12 | 8.94 | -7.66 | 0 | 3 | 0 | 24 | 302.462 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.12 | 11.16 | -45.7 | 1 | 3 | 1 | 25 | 303.47 | 5 | ↓ |
