In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 21 | Yes |
Popular Name: (1S)-N'-ethyl-N'-(2-methoxyethyl)-1-(3-methoxyphenyl)-N-propyl-ethane-1,2-diamine (1S)-N'-ethyl-N'-(2-methoxyethyl…
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) | 2.98 | 6.27 | -31.46 | 2 | 4 | 1 | 38 | 295.447 | 11 | ↓ |
Hi High (pH 8-9.5) | 2.98 | 5.35 | -4.55 | 1 | 4 | 0 | 34 | 294.439 | 11 | ↓ |
Mid Mid (pH 6-8) | 2.98 | 6.9 | -32.48 | 2 | 4 | 1 | 35 | 295.447 | 11 | ↓ |