In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 22nd, 2008 | 23 | Yes |
Popular Name: N-[(2-ethoxyphenyl)methyl]-N',N'-dimethyl-N-(4-pyridylmethyl)ethane-1,2-diamine N-[(2-ethoxyphenyl)methyl]-N',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) | 2.27 | 8.35 | -36.97 | 1 | 4 | 1 | 30 | 314.453 | 9 | ↓ |
Hi High (pH 8-9.5) | 2.27 | 6 | -5.12 | 0 | 4 | 0 | 29 | 313.445 | 9 | ↓ |
Mid Mid (pH 6-8) | 2.27 | 8.56 | -38.73 | 1 | 4 | 1 | 30 | 314.453 | 9 | ↓ |
Lo Low (pH 4.5-6) | 2.27 | 9 | -91.1 | 2 | 4 | 2 | 31 | 315.461 | 9 | ↓ |