| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 10th, 2010 | 18 | Yes |
Popular Name: (2S)-N2-[(2-fluorophenyl)methyl]-N1-isopropyl-N2-methyl-butane-1,2-diamine (2S)-N2-[(2-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) | 3.18 | 8.73 | -110.87 | 3 | 2 | 2 | 21 | 254.393 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.18 | 7.52 | -29.69 | 2 | 2 | 1 | 16 | 253.385 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.18 | 6.97 | -34.84 | 2 | 2 | 1 | 20 | 253.385 | 7 | ↓ |
