| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 10th, 2010 | 19 | Yes |
Popular Name: N-methyl-1-[6-[4-[(1R)-1-methylpropyl]piperazin-1-yl]pyridazin-3-yl]methanamine N-methyl-1-[6-[4-[(1R)-1-methylp…
| 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) | 1.36 | 6.6 | -85 | 3 | 5 | 2 | 50 | 265.405 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.36 | 3.29 | -8.16 | 1 | 5 | 0 | 44 | 263.389 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.36 | 4.74 | -41.22 | 2 | 5 | 1 | 49 | 264.397 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.36 | 5.15 | -40.31 | 2 | 5 | 1 | 45 | 264.397 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
