| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2010 | 21 | Yes |
Popular Name: N-[(3-chlorophenyl)methyl]-6-[(isopropylamino)methyl]-N-methyl-pyridazin-3-amine N-[(3-chlorophenyl)methyl]-6-[(i…
| 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) | 2.99 | 8.91 | -39.7 | 2 | 4 | 1 | 46 | 305.833 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.99 | 7.69 | -6.35 | 1 | 4 | 0 | 41 | 304.825 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.99 | 8.98 | -98.24 | 3 | 4 | 2 | 47 | 306.841 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.99 | 9.02 | -109.69 | 3 | 4 | 2 | 47 | 306.841 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
