In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2010 | 17 | Yes |
Popular Name: N-ethyl-N-[(2S)-2-ethylhexyl]-N'-isopropyl-ethane-1,2-diamine N-ethyl-N-[(2S)-2-ethylhexyl]-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) | 4.37 | 9.7 | -110.62 | 3 | 2 | 2 | 21 | 244.467 | 11 | ↓ |
Mid Mid (pH 6-8) | 4.37 | 7.92 | -34.42 | 2 | 2 | 1 | 20 | 243.459 | 11 | ↓ |
Mid Mid (pH 6-8) | 4.37 | 8.49 | -31.84 | 2 | 2 | 1 | 16 | 243.459 | 11 | ↓ |