| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 27th, 2010 | 18 | Yes |
Popular Name: 4-[(3,5-dimethylisoxazol-4-yl)methyl]-N-methyl-piperazine-1-carboxamide 4-[(3,5-dimethylisoxazol-4-yl)me…
| 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) | 0.69 | 1.88 | -14.6 | 1 | 6 | 0 | 62 | 252.318 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.69 | 4.08 | -56.09 | 2 | 6 | 1 | 63 | 253.326 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
