In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 15th, 2011 | 19 | Yes |
Popular Name: (1R)-1-[3-bromo-4-[(6R)-2,2,6-trimethylmorpholin-4-yl]phenyl]ethanamine (1R)-1-[3-bromo-4-[(6R)-2,2,6-tr…
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) | 1.66 | 6.71 | -46.54 | 3 | 3 | 1 | 40 | 328.274 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.66 | 6.39 | -3.38 | 2 | 3 | 0 | 38 | 327.266 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.