| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 25th, 2006 | 16 | Yes |
Popular Name: 8-(2-chlorophenyl)-2,7,9-triazabicyclo[4.3.0]nona-1,3,5,7-tetraene 8-(2-chlorophenyl)-2,7,9-triazab…
| 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) | 3.28 | 7.18 | -15.17 | 1 | 3 | 0 | 42 | 229.67 | 1 | ↓ |
| Hi High (pH 8-9.5) | 3.28 | 6.75 | -45.77 | 0 | 3 | -1 | 40 | 228.662 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 3.28 | 7.21 | -27.63 | 2 | 3 | 1 | 43 | 230.678 | 1 | ↓ |
