In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 21st, 2011 | 17 | Yes |
Popular Name: 1H-azepine, 1-[(hexahydro-1H-azepin-1-yl)acetyl]hexahydro- 1H-azepine, 1-[(hexahydro-1H-aze…
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) | 2.52 | 8.58 | -35.68 | 1 | 3 | 1 | 25 | 239.383 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.52 | 6.72 | -6.66 | 0 | 3 | 0 | 24 | 238.375 | 2 | ↓ |