In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2008 | 26 | Yes |
Popular Name: 1-[4-[7-chloro-3-[[[(2R)-2-hydroxypropyl]amino]methyl]-2-quinolyl]piperazin-1-yl]ethanone 1-[4-[7-chloro-3-[[[(2R)-2-hydro…
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) | 1.51 | 5.65 | -61.49 | 3 | 6 | 1 | 73 | 377.896 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.51 | 3.81 | -14.06 | 2 | 6 | 0 | 69 | 376.888 | 5 | ↓ |