In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2009 | 20 | Yes |
Popular Name: (3R)-3-[[(1R)-1-methyl-2-(1-piperidyl)ethyl]amino]-2,3-dihydrobenzofuran-6-ol (3R)-3-[[(1R)-1-methyl-2-(1-pipe…
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) | 2.32 | 5.22 | -115.86 | 4 | 4 | 2 | 51 | 278.396 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.31 | 3.39 | -38.74 | 3 | 4 | 1 | 49 | 277.388 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.32 | 4.29 | -37.77 | 3 | 4 | 1 | 46 | 277.388 | 4 | ↓ |