| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2010 | 18 | Yes |
Popular Name: N-[[(1S,3R)-1-(dimethylamino)-3-methyl-cyclohexyl]methyl]pyridazin-3-amine N-[[(1S,3R)-1-(dimethylamino)-3-…
| 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) | 2.20 | 6.88 | -92.89 | 3 | 4 | 2 | 43 | 250.39 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.20 | 4.58 | -6.7 | 1 | 4 | 0 | 41 | 248.374 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.20 | 6.7 | -40.19 | 2 | 4 | 1 | 42 | 249.382 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.20 | 6.86 | -87.58 | 3 | 4 | 2 | 43 | 250.39 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
