| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 13th, 2008 | 20 | Yes |
Popular Name: 1-methyl-4-[(4-methyl-1,4-diazepan-1-yl)sulfonyl]pyrrole-2-carboxylic 1-methyl-4-[(4-methyl-1,4-diazep…
| 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) | 0.14 | 4.17 | -79.81 | 1 | 7 | 0 | 87 | 301.368 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.14 | 2.02 | -53.86 | 0 | 7 | -1 | 86 | 300.36 | 3 | ↓ |
