In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2010 | 16 | Yes |
Popular Name: N-[(2S)-2-ethylhexyl]-N'-methyl-N-propyl-ethane-1,2-diamine N-[(2S)-2-ethylhexyl]-N'-methyl-…
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) | 4.20 | 9.07 | -112.07 | 3 | 2 | 2 | 21 | 230.44 | 11 | ↓ |
Mid Mid (pH 6-8) | 4.20 | 7.31 | -36.8 | 2 | 2 | 1 | 20 | 229.432 | 11 | ↓ |
Mid Mid (pH 6-8) | 4.20 | 7.63 | -32.15 | 2 | 2 | 1 | 16 | 229.432 | 11 | ↓ |