In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2008 | 18 | Yes |
Popular Name: (R)-3,4-dihydro-2H-1,5-benzodioxepin-7-yl-[(2S)-tetrahydrofuran-2-yl]methanamine (R)-3,4-dihydro-2H-1,5-benzodiox…
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) | -0.42 | 3.42 | -57.02 | 3 | 4 | 1 | 55 | 250.318 | 2 | ↓ |
Hi High (pH 8-9.5) | -0.42 | 3.12 | -7.88 | 2 | 4 | 0 | 54 | 249.31 | 2 | ↓ |