In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2005 | 13 | Yes |
Popular Name: 2,3-dihydro-1,4-benzodioxine-5-carboxamide 2,3-dihydro-1,4-benzodioxine-5-c…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 349550-81-8 , [349550-81-8]
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) | 0.99 | 1.59 | -13.24 | 2 | 4 | 0 | 62 | 179.175 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Mp [°C] | 130 - 132 | Acros Organics |
S phrase | S24/25: Avoid contact with skin and eyes. | Acros Organics |
No pre-computed analogs available. Try a structural similarity search.