In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 6th, 2008 | 20 | Yes |
Popular Name: 1,2-ethanediamine, N'-[(4-butoxyphenyl)methyl]-N,N-diethyl- 1,2-ethanediamine, N'-[(4-butoxy…
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) | 3.77 | 7.68 | -43.21 | 2 | 3 | 1 | 29 | 279.448 | 11 | ↓ |
Mid Mid (pH 6-8) | 3.77 | 8.49 | -34.45 | 2 | 3 | 1 | 26 | 279.448 | 11 | ↓ |
Lo Low (pH 4.5-6) | 3.77 | 9.9 | -118.91 | 3 | 3 | 2 | 30 | 280.456 | 11 | ↓ |