| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 12th, 2007 | 20 | Yes |
Popular Name: 5-methyl-9-(1-methylheptyl)-2,8,9-triazabicyclo[4.3.0]nona-1,3,5,7-tetraene-3,7-diol 5-methyl-9-(1-methylheptyl)-2,8,…
| 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) | 4.06 | 4.75 | -43.72 | 1 | 5 | -1 | 74 | 276.36 | 6 | ↓ |
| Mid Mid (pH 6-8) | 4.06 | 3.98 | -9.64 | 2 | 5 | 0 | 71 | 277.368 | 6 | ↓ |
