| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 10th, 2005 | 34 | Yes |
Popular Name: [3-(9-benzylamino-4-methyl-1,7-diazabicyclo[4.3.0]nona-2,4,6,8-tetraen-8-yl)phenyl] [3-(9-benzylamino-4-methyl-1,7-d…
| 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) | 6.38 | 16.95 | -21.97 | 1 | 5 | 0 | 56 | 451.501 | 7 | ↓ |
| Mid Mid (pH 6-8) | 6.38 | 17.33 | -31.76 | 2 | 5 | 1 | 57 | 452.509 | 7 | ↓ |
