| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2009 | 21 | Yes |
Popular Name: (2S)-2-methyl-3-[4-(1-piperidylsulfonyl)-1,4-diazepan-1-yl]propan-1-amine (2S)-2-methyl-3-[4-(1-piperidyls…
| 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) | 0.34 | 2.54 | -48.93 | 3 | 6 | 1 | 71 | 319.495 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.34 | 4.09 | -110.87 | 4 | 6 | 2 | 73 | 320.503 | 5 | ↓ |
