In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2008 | 17 | Yes |
Popular Name: (1S)-1-(2,4-dimethoxyphenyl)-2-isopropoxy-ethanamine (1S)-1-(2,4-dimethoxyphenyl)-2-i…
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) | 0.19 | 2.83 | -44.64 | 3 | 4 | 1 | 55 | 240.323 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.19 | 2.59 | -4.95 | 2 | 4 | 0 | 54 | 239.315 | 6 | ↓ |