| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 2nd, 2009 | 20 | Yes |
Popular Name: 2-[4-(4-bromo-1-methyl-pyrrole-2-carbonyl)-1,4-diazepan-1-yl]acetamide 2-[4-(4-bromo-1-methyl-pyrrole-2…
| 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) | 0.23 | 4.38 | -41.36 | 3 | 6 | 1 | 73 | 344.233 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.23 | 2.72 | -11.26 | 2 | 6 | 0 | 72 | 343.225 | 3 | ↓ |
