| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 1st, 2008 | 19 | Yes |
Popular Name: 2-amino-4-[(4-methyl-1,4-diazepan-1-yl)sulfonyl]phenol 2-amino-4-[(4-methyl-1,4-diazepa…
| 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) | 0.61 | 0.59 | -45.73 | 4 | 6 | 1 | 88 | 286.377 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.61 | -1.03 | -46.52 | 2 | 6 | -1 | 90 | 284.361 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.61 | 1.04 | -53.25 | 3 | 6 | 0 | 91 | 285.369 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.61 | -1.48 | -13.24 | 3 | 6 | 0 | 87 | 285.369 | 2 | ↓ |
