| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2011 | 16 | Yes |
Popular Name: [(2S,3R)-3-(5-bromo-2-furyl)-4-ethyl-morpholin-2-yl]methanamine [(2S,3R)-3-(5-bromo-2-furyl)-4-e…
| 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) | 1.13 | 1.22 | -42.01 | 3 | 4 | 1 | 53 | 290.181 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.13 | 0.76 | -4.16 | 2 | 4 | 0 | 52 | 289.173 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.13 | 3.43 | -99.95 | 4 | 4 | 2 | 54 | 291.189 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
