| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 4th, 2011 | 20 | Yes |
Popular Name: N-[(1S,2S,4S)-2,4-dimethylcyclohexyl]-4-methyl-phthalazin-1-amine N-[(1S,2S,4S)-2,4-dimethylcycloh…
| 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) | 4.09 | 9.39 | -23.7 | 2 | 3 | 1 | 39 | 270.4 | 2 | ↓ |
| Mid Mid (pH 6-8) | 4.09 | 9.43 | -25.29 | 2 | 3 | 1 | 39 | 270.4 | 2 | ↓ |
| Mid Mid (pH 6-8) | 4.09 | 9.31 | -10.02 | 1 | 3 | 0 | 38 | 269.392 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
