In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 20 | Yes |
Popular Name: (2S)-N1-(1-ethylpropyl)-N1-(2-methoxyethyl)-3,3-dimethyl-N2-propyl-butane-1,2-diamine (2S)-N1-(1-ethylpropyl)-N1-(2-me…
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) | 4.42 | 8.78 | -100.53 | 3 | 3 | 2 | 30 | 288.52 | 12 | ↓ |
Mid Mid (pH 6-8) | 4.42 | 9.31 | -26.1 | 2 | 3 | 1 | 26 | 287.512 | 12 | ↓ |