| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2011 | 16 | Yes |
Popular Name: 5-methyl-2-[2-[methyl-[2-(methylamino)ethyl]amino]acetyl]isoxazol-3-one 5-methyl-2-[2-[methyl-[2-(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) | -0.15 | 2.45 | -54.18 | 2 | 6 | 1 | 72 | 228.272 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.15 | 0.99 | -16.25 | 1 | 6 | 0 | 67 | 227.264 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
