| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 15th, 2011 | 15 | Yes |
Popular Name: 1-[(3,5-dimethylisoxazol-4-yl)methyl]-3-methylpiperidine 1-[(3,5-dimethylisoxazol-4-yl)me…
None
| 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) | 1.75 | 6.99 | -42.03 | 1 | 3 | 1 | 30 | 209.313 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.75 | 4.76 | -6.08 | 0 | 3 | 0 | 29 | 208.305 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.