| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 27th, 2010 | 19 | Yes |
Popular Name: N-[(5-methylisoxazol-3-yl)methyl]-1-prop-2-ynyl-piperidine-4-carboxamide N-[(5-methylisoxazol-3-yl)methyl…
| 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) | 0.73 | 3.34 | -11.61 | 1 | 5 | 0 | 58 | 261.325 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.73 | 5.62 | -46.22 | 2 | 5 | 1 | 60 | 262.333 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
