| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 13 | Yes |
Popular Name: 5-(4-Amino-phenyl)-2H-pyrazol-3-ylamine 5-(4-Amino-phenyl)-2H-pyrazol-3-…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 60706-60-7 , 802863-65-6
| 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) | 0.36 | 1.78 | -33.43 | 5 | 4 | 1 | 78 | 175.215 | 1 | ↓ |
| Hi High (pH 8-9.5) | 0.68 | 1.24 | -8.11 | 5 | 4 | 0 | 81 | 174.207 | 1 | ↓ |
| Mid Mid (pH 6-8) | 0.68 | 1.2 | -7.12 | 5 | 4 | 0 | 81 | 174.207 | 1 | ↓ |
| Mid Mid (pH 6-8) | 0.68 | 1.35 | -27.36 | 6 | 4 | 1 | 82 | 175.215 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 0.68 | 1.36 | -27.76 | 6 | 4 | 1 | 82 | 175.215 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | US5453514 | IBM Patent Data |
