In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2011 | 20 | Yes |
Popular Name: [(2R,3S)-3-(2,3-dihydrobenzofuran-5-yl)-4-propyl-morpholin-2-yl]methanamine [(2R,3S)-3-(2,3-dihydrobenzofura…
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) | 1.47 | 3.23 | -42.68 | 3 | 4 | 1 | 49 | 277.388 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.47 | 2.85 | -4.22 | 2 | 4 | 0 | 48 | 276.38 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.47 | 4.86 | -110.45 | 4 | 4 | 2 | 51 | 278.396 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.