| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 31st, 2011 | 14 | No |
Popular Name: 3-[(2S,4S)-4-chloro-2-methyl-tetrahydropyran-2-yl]pyridine 3-[(2S,4S)-4-chloro-2-methyl-tet…
| 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) | 2.08 | 5.03 | -4.38 | 0 | 2 | 0 | 22 | 211.692 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 2.08 | 5.52 | -31.22 | 1 | 2 | 1 | 23 | 212.7 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
