In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 21st, 2010 | 19 | Yes |
Popular Name: (2R)-1-(4-bromophenyl)-2-(3,3-dimethylmorpholin-4-yl)propan-1-one (2R)-1-(4-bromophenyl)-2-(3,3-di…
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) | 3.29 | 5.29 | -5.72 | 0 | 3 | 0 | 30 | 326.234 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.29 | 7.12 | -36.89 | 1 | 3 | 1 | 31 | 327.242 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.