| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 16th, 2008 | 11 | Yes |
Popular Name: 7-AMINOISOINDOLIN-1-ONE 7-AMINOISOINDOLIN-1-ONE
Find On: PubMed — Wikipedia — Google
CAS Number: 169044-98-8
| 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) | 0.15 | -0.01 | -9.25 | 3 | 3 | 0 | 55 | 148.165 | 0 | ↓ |
| Mid Mid (pH 6-8) | 0.22 | -1.63 | -30.21 | 4 | 3 | 1 | 60 | 149.173 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| PUBCHEM_PATENT_ID | EP0686625B1; US5716993 | IBM Patent Data |
