| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2009 | 19 | Yes |
Popular Name: N-[[4-(aminomethyl)-2-fluoro-phenyl]methyl]-N-methyl-1-(3-pyridyl)methanamine N-[[4-(aminomethyl)-2-fluoro-phe…
| 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) | 1.18 | 6.23 | -98.88 | 4 | 3 | 2 | 45 | 261.344 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.18 | 3.49 | -5.8 | 2 | 3 | 0 | 42 | 259.328 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.18 | 3.9 | -49.82 | 3 | 3 | 1 | 44 | 260.336 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.18 | 5.83 | -40.66 | 3 | 3 | 1 | 43 | 260.336 | 5 | ↓ |
