In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 21 | Yes |
Popular Name: (1S)-N'-[(1S)-1,2-dimethylpropyl]-1-(4-ethoxyphenyl)-N-ethyl-N'-methyl-ethane-1,2-diamine (1S)-N'-[(1S)-1,2-dimethylpropyl…
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) | 3.97 | 9.87 | -117.67 | 3 | 3 | 2 | 30 | 294.483 | 9 | ↓ |
Mid Mid (pH 6-8) | 3.97 | 8.89 | -32.81 | 2 | 3 | 1 | 26 | 293.475 | 9 | ↓ |
Mid Mid (pH 6-8) | 3.97 | 8.51 | -35.3 | 2 | 3 | 1 | 29 | 293.475 | 9 | ↓ |