| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 7th, 2006 | 22 | Yes |
Popular Name: 2-(4-phenyl-1,5,7,9-tetrazabicyclo[4.3.0]nona-3,6,8-trien-2-yl)phenol 2-(4-phenyl-1,5,7,9-tetrazabicyc…
| 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) | 3.04 | 9.41 | -12.13 | 1 | 5 | 0 | 63 | 290.326 | 2 | ↓ |
| Mid Mid (pH 6-8) | 3.04 | 10.41 | -47.79 | 3 | 5 | 1 | 67 | 291.334 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 3.04 | 9.75 | -32.42 | 2 | 5 | 1 | 65 | 291.334 | 2 | ↓ |
