| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 9th, 2006 | 30 | No |
Popular Name: 3-(4-chlorophenyl)-5-(o-tolyl)-8-(p-tolyl)-2,6,7,9-tetrazabicyclo[4.3.0]nona-3,7,9-triene 3-(4-chlorophenyl)-5-(o-tolyl)-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) | 6.74 | 17.92 | -31.45 | 2 | 4 | 1 | 48 | 413.932 | 3 | ↓ |
| Mid Mid (pH 6-8) | 6.74 | 16.71 | -37.21 | 1 | 4 | 1 | 45 | 413.932 | 3 | ↓ |
| Mid Mid (pH 6-8) | 6.74 | 16.3 | -15.09 | 0 | 4 | 0 | 43 | 412.924 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 6.74 | 16.76 | -27.66 | 1 | 4 | 1 | 44 | 413.932 | 3 | ↓ |
