In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 26th, 2010 | 16 | Yes |
Popular Name: (3S)-4-[(4-bromo-2-fluoro-phenyl)methyl]-3-methyl-morpholine (3S)-4-[(4-bromo-2-fluoro-phenyl…
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) | 2.82 | 4.87 | -3.62 | 0 | 2 | 0 | 12 | 288.16 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.82 | 7.06 | -35.12 | 1 | 2 | 1 | 14 | 289.168 | 2 | ↓ |