In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 20 | Yes |
Popular Name: [(3R)-3-(hydroxymethyl)-1-piperidyl]-[(3S)-1,2,3,4-tetrahydroisoquinolin-3-yl]methanone [(3R)-3-(hydroxymethyl)-1-piperi…
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) | 0.97 | 2.73 | -9.63 | 2 | 4 | 0 | 53 | 274.364 | 2 | ↓ |
Lo Low (pH 4.5-6) | 0.97 | 4.04 | -41.06 | 3 | 4 | 1 | 57 | 275.372 | 2 | ↓ |