| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 5th, 2010 | 21 | Yes |
Popular Name: (1S,2S)-N1-benzyl-1-(4-fluorophenyl)-N1-methyl-butane-1,2-diamine (1S,2S)-N1-benzyl-1-(4-fluorophe…
| 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) | 3.23 | 9.41 | -125.77 | 4 | 2 | 2 | 32 | 288.41 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.23 | 7.95 | -46.35 | 3 | 2 | 1 | 31 | 287.402 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.23 | 9.1 | -39.56 | 3 | 2 | 1 | 30 | 287.402 | 6 | ↓ |
