| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 19th, 2011 | 20 | Yes |
Popular Name: 3-[[(2S,6R)-2,6-dimethylpiperazin-1-yl]methyl]-1,2,3-benzotriazin-4-one 3-[[(2S,6R)-2,6-dimethylpiperazi…
| 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) | 0.88 | 2.82 | -39.95 | 2 | 6 | 1 | 68 | 274.348 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.88 | 1.45 | -8.07 | 1 | 6 | 0 | 63 | 273.34 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
