| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 2nd, 2012 | 15 | Yes |
Popular Name: 3-amino-1-(1,3-dimethyl-1H-pyrazol-5-yl)piperidin-2-one 3-amino-1-(1,3-dimethyl-1H-pyraz…
Find On: PubMed — Wikipedia — Google
CAS Number: 1354950-73-4
| 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) | -0.58 | 2.48 | -51.53 | 3 | 5 | 1 | 66 | 209.273 | 1 | ↓ |
| Hi High (pH 8-9.5) | -0.58 | 2.15 | -12.14 | 2 | 5 | 0 | 64 | 208.265 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 88 - 90 | Enamine Building Blocks |
| MP | 88...90 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
No pre-computed analogs available. Try a structural similarity search.
