| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2010 | 15 | Yes |
Popular Name: (2S)-N1-[(4-fluorophenyl)methyl]-N1,N2-dimethyl-propane-1,2-diamine (2S)-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) | 2.02 | 7.18 | -122.24 | 3 | 2 | 2 | 21 | 212.312 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.02 | 5.88 | -39.71 | 2 | 2 | 1 | 16 | 211.304 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.02 | 5.3 | -38.47 | 2 | 2 | 1 | 20 | 211.304 | 5 | ↓ |
