| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 23rd, 2008 | 33 | 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) | 1.92 | 4.3 | -46.84 | 1 | 8 | -1 | 111 | 462.555 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.92 | 4.72 | -67.29 | 2 | 8 | 0 | 112 | 463.563 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.46 | 6.57 | -52.77 | 3 | 8 | 1 | 109 | 464.571 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![6-keto-N-[[7-(4,5,6,7-tetrahydroisobenzothiophene-1-carbonyl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]-1H-pyridazine-3-carboxamide](http://zinc12.docking.org/img/rings/80093.gif)