| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 4th, 2010 | 19 | Yes |
Popular Name: 2-[4-(5-bromothiophene-2-carbonyl)-1,4-diazepan-1-yl]acetamide 2-[4-(5-bromothiophene-2-carbony…
| 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) | 1.10 | 3.76 | -48.92 | 3 | 5 | 1 | 68 | 347.258 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.10 | 2.08 | -11.89 | 2 | 5 | 0 | 67 | 346.25 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
