| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 11th, 2005 | 30 | Yes |
Popular Name: 5-benzyloxy-N-cyclohexyl-8-(2-pyridyl)-1,7-diazabicyclo[4.3.0]nona-2,4,6,8-tetraen-9-amine 5-benzyloxy-N-cyclohexyl-8-(2-py…
| 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) | 5.32 | 12.51 | -14.08 | 1 | 5 | 0 | 51 | 398.51 | 6 | ↓ |
| Mid Mid (pH 6-8) | 5.32 | 12.95 | -25.7 | 2 | 5 | 1 | 53 | 399.518 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 5.32 | 13.01 | -34.08 | 2 | 5 | 1 | 53 | 399.518 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 5.32 | 13.45 | -82.02 | 3 | 5 | 2 | 54 | 400.526 | 6 | ↓ |
