| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 13th, 2008 | 19 | Yes |
Popular Name: 4-[(4-methyl-1,4-diazepan-1-yl)sulfonyl]-1H-pyrrole-2-carboxylic 4-[(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) | 0.07 | 2.39 | -75.3 | 2 | 7 | 0 | 98 | 287.341 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.07 | 0.24 | -51.03 | 1 | 7 | -1 | 97 | 286.333 | 3 | ↓ |
