In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 26th, 2009 | 20 | Yes |
Popular Name: (1S)-1-(benzofuran-2-yl)-2-[(3R)-3-ethylmorpholin-4-yl]ethanamine (1S)-1-(benzofuran-2-yl)-2-[(3R)…
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) | 0.73 | 4.08 | -44.42 | 3 | 4 | 1 | 53 | 275.372 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.73 | 3.33 | -5.29 | 2 | 4 | 0 | 52 | 274.364 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.73 | 5.9 | -129.95 | 4 | 4 | 2 | 54 | 276.38 | 4 | ↓ |