In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2009 | 17 | Yes |
Popular Name: (2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)morpholine (2R)-2-(3,4-dihydro-2H-1,5-benzo…
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) | 0.95 | 3.83 | -47.25 | 2 | 4 | 1 | 44 | 236.291 | 1 | ↓ |
Hi High (pH 8-9.5) | 0.95 | 2.46 | -6.21 | 1 | 4 | 0 | 40 | 235.283 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.