| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2009 | 19 | Yes |
Popular Name: 3-[(4-methyl-1,4-diazepan-1-yl)sulfonylmethyl]aniline 3-[(4-methyl-1,4-diazepan-1-yl)s…
| 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) | 0.53 | 3.61 | -50.42 | 3 | 5 | 1 | 68 | 284.405 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.53 | 1.5 | -10.52 | 2 | 5 | 0 | 67 | 283.397 | 3 | ↓ |
