In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 20th, 2011 | 23 | Yes |
Popular Name: 1,2-ethanediamine, N'-(2-butoxyphenyl)-N-ethyl-N-phenyl- 1,2-ethanediamine, N'-(2-butoxyp…
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) | 5.34 | 10.66 | -4.17 | 1 | 3 | 0 | 24 | 312.457 | 10 | ↓ |
Lo Low (pH 4.5-6) | 5.34 | 10.75 | -19.51 | 2 | 3 | 0 | 26 | 313.465 | 10 | ↓ |
Lo Low (pH 4.5-6) | 5.34 | 11.25 | -37.18 | 2 | 3 | 1 | 29 | 313.465 | 10 | ↓ |