| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2004 | 14 | Yes |
Popular Name: 4-amino-3,4-dihydro-2H-1-benzopyran-4-carboxylic acid hydrate 4-amino-3,4-dihydro-2H-1-benzopy…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1308647-64-4 , 412924-90-4
| 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) | 0.76 | -2.37 | -37.49 | 3 | 4 | 0 | 77 | 193.202 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 239 - 241 | Enamine Building Blocks |
| MP | 239...241 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| PUBCHEM_PATENT_ID | US4704461 | IBM Patent Data |
