In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 26th, 2009 | 16 | Yes |
Popular Name: 3-(2,3-dihydro-1,4-benzodioxin-5-yl)-1,2-oxazol-5-amine 3-(2,3-dihydro-1,4-benzodioxin-5…
Find On: PubMed — Wikipedia — Google
CAS Number: 1156753-33-1
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) | 1.38 | 1.49 | -12.78 | 2 | 5 | 0 | 71 | 218.212 | 1 | ↓ |
Lo Low (pH 4.5-6) | 1.38 | 1.36 | -28.09 | 3 | 5 | 1 | 72 | 219.22 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
No pre-computed analogs available. Try a structural similarity search.