| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2008 | 31 | Yes |
| 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) | 3.04 | 10.89 | -121.64 | 2 | 7 | 2 | 62 | 428.577 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.04 | 8.2 | -12.99 | 0 | 7 | 0 | 60 | 426.561 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.04 | 8.56 | -34.68 | 1 | 7 | 1 | 61 | 427.569 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.04 | 10.52 | -57.5 | 1 | 7 | 1 | 61 | 427.569 | 7 | ↓ |
![5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine](http://zinc12.docking.org/img/rings/25634.gif)
![7-benzyl-4-pyrrolidino-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine](http://zinc12.docking.org/img/rings/50921.gif)
