| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 12th, 2006 | 23 | Yes |
Popular Name: 2-[2-(4-chlorophenyl)-1,5,7,9-tetrazabicyclo[4.3.0]nona-3,6,8-trien-4-yl]phenol 2-[2-(4-chlorophenyl)-1,5,7,9-te…
| 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) | 3.72 | 9.85 | -14.69 | 1 | 5 | 0 | 63 | 324.771 | 2 | ↓ |
| Hi High (pH 8-9.5) | 3.72 | 10.65 | -55.66 | 0 | 5 | -1 | 66 | 323.763 | 2 | ↓ |
| Mid Mid (pH 6-8) | 3.72 | 11.2 | -47.65 | 3 | 5 | 1 | 67 | 325.779 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 3.72 | 9.67 | -9.34 | 2 | 5 | 0 | 65 | 325.779 | 2 | ↓ |
