In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 11th, 2008 | 23 | Yes |
Popular Name: (3R)-3-[2-(azepan-1-yl)-2-oxo-ethyl]-4-(2-thienylmethyl)piperazin-2-one (3R)-3-[2-(azepan-1-yl)-2-oxo-et…
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) | 2.85 | -1.9 | -40.7 | 2 | 5 | 1 | 54 | 336.481 | 4 | ↓ |