| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 3rd, 2010 | 21 | Yes |
Popular Name: 4-[2-dimethylaminoethyl(propyl)amino]-1-(4-fluorophenyl)butan-1-one 4-[2-dimethylaminoethyl(propyl)a…
| 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) | 3.10 | 9.15 | -42.93 | 1 | 3 | 1 | 25 | 295.422 | 10 | ↓ |
| Hi High (pH 8-9.5) | 3.10 | 6.68 | -7.15 | 0 | 3 | 0 | 24 | 294.414 | 10 | ↓ |
| Mid Mid (pH 6-8) | 3.10 | 8.82 | -42.66 | 1 | 3 | 1 | 25 | 295.422 | 10 | ↓ |
| Mid Mid (pH 6-8) | 3.10 | 11.29 | -114.01 | 2 | 3 | 2 | 26 | 296.43 | 10 | ↓ |
