In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2011 | 16 | Yes |
Popular Name: (2R,4S)-2-ethyl-4-(6-methyl-3-pyridyl)tetrahydropyran-4-ol (2R,4S)-2-ethyl-4-(6-methyl-3-py…
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) | 1.40 | 3.27 | -6.18 | 1 | 3 | 0 | 42 | 221.3 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.40 | 3.72 | -33.74 | 2 | 3 | 1 | 44 | 222.308 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.