In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2010 | 22 | No |
Popular Name: 2-[(2S)-1-(1,3-dihydrothieno[3,4-b]quinolin-9-yl)-2-piperidyl]ethanol 2-[(2S)-1-(1,3-dihydrothieno[3,4…
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) | 3.52 | 7.45 | -26.47 | 2 | 3 | 1 | 38 | 315.462 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.52 | 7.08 | -8.05 | 1 | 3 | 0 | 36 | 314.454 | 3 | ↓ |