In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 21 | Yes |
Popular Name: (1S)-1-(2,4-dimethoxyphenyl)-N'-(1-ethylpropyl)-N,N'-dimethyl-ethane-1,2-diamine (1S)-1-(2,4-dimethoxyphenyl)-N'-…
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) | 3.50 | 7.58 | -109.72 | 3 | 4 | 2 | 40 | 296.455 | 9 | ↓ |
Mid Mid (pH 6-8) | 3.50 | 6.45 | -30.43 | 2 | 4 | 1 | 35 | 295.447 | 9 | ↓ |
Mid Mid (pH 6-8) | 3.50 | 6.23 | -35.11 | 2 | 4 | 1 | 38 | 295.447 | 9 | ↓ |