In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 21 | Yes |
Popular Name: (1S)-1-(3-bromo-4-methoxy-phenyl)-N-[(1R)-1-(2-bromophenyl)ethyl]ethanamine (1S)-1-(3-bromo-4-methoxy-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) | 5.57 | 9.94 | -44.1 | 2 | 2 | 1 | 26 | 414.161 | 5 | ↓ |
Mid Mid (pH 6-8) | 5.57 | 8.99 | -5.19 | 1 | 2 | 0 | 21 | 413.153 | 5 | ↓ |