In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 3rd, 2010 | 21 | Yes |
Popular Name: (2S)-N2-[(3-ethoxy-2-methoxy-phenyl)methyl]-N1,N1-diethyl-propane-1,2-diamine (2S)-N2-[(3-ethoxy-2-methoxy-phe…
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) | 2.80 | 7.19 | -33.32 | 2 | 4 | 1 | 38 | 295.447 | 10 | ↓ |
Mid Mid (pH 6-8) | 2.80 | 7.68 | -36.66 | 2 | 4 | 1 | 35 | 295.447 | 10 | ↓ |
Lo Low (pH 4.5-6) | 2.80 | 8.94 | -110.69 | 3 | 4 | 2 | 40 | 296.455 | 10 | ↓ |