| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 29th, 2011 | 16 | Yes |
Popular Name: (3S,4R)-1-[(4,5-dimethyloxazol-2-yl)methyl]-4-methyl-piperidin-3-amine (3S,4R)-1-[(4,5-dimethyloxazol-2…
| 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) | 0.45 | 2.32 | -35.46 | 3 | 4 | 1 | 56 | 224.328 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 0.45 | 2.61 | -116.63 | 4 | 4 | 2 | 58 | 225.336 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
