| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 24th, 2009 | 20 | Yes |
Popular Name: (1S)-1-(4-fluorophenyl)-N,N-dimethyl-N'-(4-pyridylmethyl)ethane-1,2-diamine (1S)-1-(4-fluorophenyl)-N,N-dime…
| 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) | 1.98 | 7.45 | -45.66 | 2 | 3 | 1 | 29 | 274.363 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.98 | 5.14 | -4.91 | 1 | 3 | 0 | 28 | 273.355 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.98 | 7.88 | -95.21 | 3 | 3 | 2 | 31 | 275.371 | 6 | ↓ |
