In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 30th, 2011 | 15 | Yes |
Popular Name: [(2R,3R)-3-(5-bromo-2-furyl)-4-methyl-morpholin-2-yl]methanamine [(2R,3R)-3-(5-bromo-2-furyl)-4-m…
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) | 0.75 | 0.35 | -44.52 | 3 | 4 | 1 | 53 | 276.154 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.75 | -0.11 | -5.5 | 2 | 4 | 0 | 52 | 275.146 | 2 | ↓ |
Lo Low (pH 4.5-6) | 0.75 | 2.76 | -107.75 | 4 | 4 | 2 | 54 | 277.162 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.