| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2010 | 19 | Yes |
Popular Name: (3S)-3-(4-pyridazin-3-yl-1,4-diazepan-1-yl)pentan-1-amine (3S)-3-(4-pyridazin-3-yl-1,4-dia…
| 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) | 0.54 | 4.5 | -49.41 | 3 | 5 | 1 | 60 | 264.397 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.54 | 5.77 | -116.65 | 4 | 5 | 2 | 61 | 265.405 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
