In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 16 | Yes |
Popular Name: (2S)-N'-ethyl-N'-(6-ethylpyrimidin-4-yl)-2-methyl-propane-1,3-diamine (2S)-N'-ethyl-N'-(6-ethylpyrimid…
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) | 1.18 | 6.12 | -44.52 | 3 | 4 | 1 | 57 | 223.344 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.18 | 6.51 | -86.14 | 4 | 4 | 2 | 58 | 224.352 | 6 | ↓ |