In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 10th, 2009 | 19 | Yes |
Popular Name: [(3R)-3-hydroxy-1-piperidyl]-[(3R)-1,2,3,4-tetrahydroisoquinolin-3-yl]methanone [(3R)-3-hydroxy-1-piperidyl]-[(3…
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) | 0.59 | 2.08 | -9.65 | 2 | 4 | 0 | 53 | 260.337 | 1 | ↓ |
Lo Low (pH 4.5-6) | 0.59 | 3.42 | -41.96 | 3 | 4 | 1 | 57 | 261.345 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.