In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 21 | Yes |
Popular Name: (1S)-1-(2,4-dimethoxyphenyl)-N'-ethyl-N'-(2-methoxyethyl)-N-methyl-ethane-1,2-diamine (1S)-1-(2,4-dimethoxyphenyl)-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) | 2.11 | 3.9 | -33.19 | 2 | 5 | 1 | 48 | 297.419 | 10 | ↓ |
Hi High (pH 8-9.5) | 2.11 | 3.14 | -4.67 | 1 | 5 | 0 | 43 | 296.411 | 10 | ↓ |
Mid Mid (pH 6-8) | 2.11 | 4.85 | -32.7 | 2 | 5 | 1 | 44 | 297.419 | 10 | ↓ |