| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2009 | 21 | Yes |
Popular Name: (2S)-3-[4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]-2-methyl-propan-1-amine (2S)-3-[4-[(4-methoxyphenyl)meth…
| 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) | 1.51 | 4.1 | -44.7 | 3 | 4 | 1 | 43 | 292.447 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.51 | 5.87 | -94.31 | 4 | 4 | 2 | 45 | 293.455 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.51 | 5.78 | -106.8 | 4 | 4 | 2 | 45 | 293.455 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.51 | 7.6 | -202.96 | 5 | 4 | 3 | 46 | 294.463 | 6 | ↓ |
