In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 21 | Yes |
Popular Name: (1S)-1-(benzofuran-2-yl)-N-ethyl-N'-(1-ethylpropyl)-N'-methyl-ethane-1,2-diamine (1S)-1-(benzofuran-2-yl)-N-ethyl…
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) | 4.39 | 10.2 | -116.39 | 3 | 3 | 2 | 34 | 290.451 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.39 | 8.82 | -34.01 | 2 | 3 | 1 | 33 | 289.443 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.39 | 9.21 | -33.16 | 2 | 3 | 1 | 30 | 289.443 | 8 | ↓ |