| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 10th, 2006 | 29 | Yes |
Popular Name: 3-(4-bromophenyl)-5-(4-chlorophenyl)-8-methyl-2,6,7,9-tetrazabicyclo[4.3.0]nona-3,7,9-triene 3-(4-bromophenyl)-5-(4-chlorophe…
| 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) | 5.61 | 15.43 | -13.68 | 0 | 4 | 0 | 43 | 398.897 | 3 | ↓ |
| Mid Mid (pH 6-8) | 5.61 | 16.69 | -27.95 | 2 | 4 | 1 | 48 | 399.905 | 3 | ↓ |
| Mid Mid (pH 6-8) | 5.61 | 15.9 | -28.04 | 1 | 4 | 1 | 44 | 399.905 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 5.61 | 15.76 | -35.21 | 1 | 4 | 1 | 45 | 399.905 | 3 | ↓ |
