| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 24th, 2009 | 20 | Yes |
Popular Name: (1S)-N'-benzyl-1-(4-fluorophenyl)-N,N-dimethyl-ethane-1,2-diamine (1S)-N'-benzyl-1-(4-fluorophenyl…
| 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) | 3.27 | 9.21 | -41.68 | 2 | 2 | 1 | 16 | 273.375 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.27 | 6.91 | -3.04 | 1 | 2 | 0 | 15 | 272.367 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.27 | 8.16 | -43.22 | 2 | 2 | 1 | 20 | 273.375 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.27 | 10.63 | -133.34 | 3 | 2 | 2 | 21 | 274.383 | 6 | ↓ |
