In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 8th, 2008 | 23 | Yes |
Popular Name: 2-[2-[(3S)-3-methyl-1-piperidyl]ethylamino]quinoline-4-carboxylic 2-[2-[(3S)-3-methyl-1-piperidyl]…
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) | 3.12 | 8.66 | -66.97 | 2 | 5 | 0 | 69 | 313.401 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.12 | 9.11 | -97.61 | 3 | 5 | 1 | 71 | 314.409 | 5 | ↓ |