| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2009 | 21 | Yes |
Popular Name: (2S)-2-methyl-3-[4-(3-pyridylsulfonyl)-1,4-diazepan-1-yl]propan-1-amine (2S)-2-methyl-3-[4-(3-pyridylsul…
| 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) | -0.11 | 1.57 | -50.28 | 3 | 6 | 1 | 81 | 313.447 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.11 | 3.13 | -113.7 | 4 | 6 | 2 | 82 | 314.455 | 5 | ↓ |
