| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 29th, 2008 | 22 | No |
Popular Name: 3-(phenyldiazenyl)-4,5,6,7-tetrahydro-1H-cyclopenta[d]pyrazolo[1,5-a]pyrimidine-2,8-dione 3-(phenyldiazenyl)-4,5,6,7-tetra…
| 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) | 2.46 | 3.29 | -17.95 | 2 | 7 | 0 | 95 | 295.302 | 2 | ↓ |
| Ref Reference (pH 7) | 2.46 | 4.99 | -17.09 | 2 | 7 | 0 | 95 | 295.302 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.19 | 3.18 | -52.48 | 1 | 7 | -1 | 95 | 294.294 | 2 | ↓ |
| Hi High (pH 8-9.5) | 3.38 | 1.61 | -133.85 | 0 | 7 | -2 | 101 | 293.286 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.19 | 3.21 | -57.61 | 1 | 7 | -1 | 95 | 294.294 | 2 | ↓ |
| Mid Mid (pH 6-8) | 3.38 | 0.83 | -49.11 | 1 | 7 | -1 | 98 | 294.294 | 2 | ↓ |
