In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 1st, 2010 | 17 | No |
Popular Name: (E)-4-(4-acetyl-1,4-diazepan-1-yl)-4-oxo-but-2-enoic (E)-4-(4-acetyl-1,4-diazepan-1-y…
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) | -1.05 | 5.28 | -49.85 | 0 | 6 | -1 | 81 | 239.251 | 2 | ↓ |