In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 21 | Yes |
Popular Name: (1S,2S)-N1-ethyl-N2,N2-bis(2-methoxyethyl)-1-phenyl-propane-1,2-diamine (1S,2S)-N1-ethyl-N2,N2-bis(2-met…
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) | 2.38 | 5.46 | -29.04 | 2 | 4 | 1 | 38 | 295.447 | 11 | ↓ |
Hi High (pH 8-9.5) | 2.38 | 4.8 | -2.75 | 1 | 4 | 0 | 34 | 294.439 | 11 | ↓ |
Mid Mid (pH 6-8) | 2.38 | 7.85 | -27.88 | 2 | 4 | 1 | 35 | 295.447 | 11 | ↓ |