| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 7th, 2010 | 21 | Yes |
Popular Name: Tert-butyl 4-(5-chloro-6-oxo-1,6-dihydropyridazin-4-yl)piperazine-1-carboxylate Tert-butyl 4-(5-chloro-6-oxo-1,6…
Find On: PubMed — Wikipedia — Google
CAS Number: 1062118-80-2
1-Piperazinecarboxylic acid, 4-(5-chloro-1,6-dihydro-6-oxo-4-pyridazinyl)-, 1,1-dimethylethyl ester
4-(5-Chloro-6-oxo-1,6-dihydro-pyridazin-4-yl)-piperazine-1-carboxylic acid tert-butyl ester
tert-butyl 4-(5-chloro-6-oxo-1,6-dihydro-4-pyridazinyl)tetrahydro-1(2H)-pyrazinecarboxylate
| 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) | 1.68 | 2.38 | -43.07 | 0 | 7 | -1 | 82 | 313.765 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.22 | 3.88 | -13.19 | 1 | 7 | 0 | 79 | 314.773 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
