| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 12th, 2010 | 11 | Yes |
Popular Name: 5-(tert-Butyl)-4-chloro-1H-pyrazol-3-amine 5-(tert-Butyl)-4-chloro-1H-pyraz…
Find On: PubMed — Wikipedia — Google
CAS Number: 110086-11-8
| 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) | 2.48 | 2.55 | -4.4 | 3 | 3 | 0 | 55 | 173.647 | 1 | ↓ |
| Mid Mid (pH 6-8) | 2.48 | 2.57 | -4.81 | 3 | 3 | 0 | 55 | 173.647 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 2.48 | 2.68 | -27.08 | 4 | 3 | 1 | 56 | 174.655 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0602751B1; US5378587; US5571926 | IBM Patent Data |
