| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2010 | 19 | Yes |
Popular Name: 2,2-dimethyl-1-[4-[(3-methylisoxazol-5-yl)methyl]piperazin-1-yl]propan-1-one 2,2-dimethyl-1-[4-[(3-methylisox…
| 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) | 1.60 | 4.14 | -12.68 | 0 | 5 | 0 | 50 | 265.357 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.60 | 6.36 | -53.3 | 1 | 5 | 1 | 51 | 266.365 | 3 | ↓ |
