| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2010 | 16 | Yes |
Popular Name: (3S)-N1-[(4-fluorophenyl)methyl]-N1,N3-dimethyl-butane-1,3-diamine (3S)-N1-[(4-fluorophenyl)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) | 2.29 | 5.37 | -39.62 | 2 | 2 | 1 | 20 | 225.331 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.29 | 6.4 | -42.33 | 2 | 2 | 1 | 16 | 225.331 | 6 | ↓ |
