| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 1st, 2009 | 18 | Yes |
Popular Name: 3-amino-1-[4-[(3-methylisoxazol-5-yl)methyl]piperazin-1-yl]propan-1-one 3-amino-1-[4-[(3-methylisoxazol-…
| 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) | -1.03 | 0.82 | -56.65 | 3 | 6 | 1 | 77 | 253.326 | 4 | ↓ |
| Mid Mid (pH 6-8) | -1.03 | 3.02 | -112.85 | 4 | 6 | 2 | 78 | 254.334 | 4 | ↓ |
