| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 24th, 2006 | 22 | Yes |
Popular Name: 3-bromo-8-(3,4,5-trimethoxyphenyl)-5,7,9-triazabicyclo[4.3.0]nona-2,4,7,10-tetraene 3-bromo-8-(3,4,5-trimethoxypheny…
| 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) | 3.23 | 6 | -13.25 | 1 | 6 | 0 | 69 | 364.199 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.23 | 6.44 | -36.76 | 2 | 6 | 1 | 71 | 365.207 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.23 | 6.29 | -42.5 | 2 | 6 | 1 | 71 | 365.207 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.23 | 6.69 | -111.11 | 3 | 6 | 2 | 72 | 366.215 | 4 | ↓ |
