| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2009 | 18 | Yes |
Popular Name: (2S)-2-methyl-3-(4-propylsulfonyl-1,4-diazepan-1-yl)propan-1-amine (2S)-2-methyl-3-(4-propylsulfony…
| 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) | 0.31 | 1.74 | -50.73 | 3 | 5 | 1 | 68 | 278.442 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.31 | 3.2 | -129.41 | 4 | 5 | 2 | 69 | 279.45 | 6 | ↓ |
