In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 30th, 2008 | 25 | Yes |
Popular Name: (5R)-1-benzyl-5-(2-diethylaminoethyl-ethyl-amino)azepan-2-one (5R)-1-benzyl-5-(2-diethylaminoe…
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) | 2.91 | 10.07 | -46.49 | 1 | 4 | 1 | 28 | 346.539 | 9 | ↓ |
Mid Mid (pH 6-8) | 2.91 | 12.35 | -121.49 | 2 | 4 | 2 | 29 | 347.547 | 9 | ↓ |
Mid Mid (pH 6-8) | 2.91 | 10.33 | -39.96 | 1 | 4 | 1 | 28 | 346.539 | 9 | ↓ |