In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 16 | Yes |
Popular Name: (2S)-N'-ethyl-2-methyl-N'-(2-morpholinoethyl)propane-1,3-diamine (2S)-N'-ethyl-2-methyl-N'-(2-mor…
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) | 0.14 | 2.12 | -105.95 | 4 | 4 | 2 | 45 | 231.384 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.14 | 0.33 | -44.11 | 3 | 4 | 1 | 43 | 230.376 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.14 | 2.61 | -95.66 | 4 | 4 | 2 | 45 | 231.384 | 7 | ↓ |
Lo Low (pH 4.5-6) | 0.14 | 4.39 | -200.71 | 5 | 4 | 3 | 46 | 232.392 | 7 | ↓ |