| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2009 | 19 | Yes |
Popular Name: (1S)-1-(4-fluorophenyl)-N-methyl-N-(2-pyridylmethyl)ethane-1,2-diamine (1S)-1-(4-fluorophenyl)-N-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) | 1.12 | 4.49 | -53.39 | 3 | 3 | 1 | 44 | 260.336 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.12 | 6.59 | -124.52 | 4 | 3 | 2 | 45 | 261.344 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.12 | 4.75 | -111.4 | 4 | 3 | 2 | 45 | 261.344 | 5 | ↓ |
