In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 19 | Yes |
Popular Name: 1-[4-[(1R)-3-amino-1-ethyl-propyl]-1,4-diazepan-1-yl]-2-ethoxy-ethanone 1-[4-[(1R)-3-amino-1-ethyl-propy…
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) | 0.13 | 5.48 | -113.99 | 4 | 5 | 2 | 62 | 273.421 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.13 | 3.97 | -47.94 | 3 | 5 | 1 | 60 | 272.413 | 7 | ↓ |