In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 20 | Yes |
Popular Name: [(3R)-3-ethyl-1-piperidyl]-[(3S)-1,2,3,4-tetrahydroisoquinolin-3-yl]methanone [(3R)-3-ethyl-1-piperidyl]-[(3S)…
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) | 2.48 | 6.67 | -7.81 | 1 | 3 | 0 | 32 | 272.392 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.48 | 7.99 | -38.84 | 2 | 3 | 1 | 37 | 273.4 | 2 | ↓ |