In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 27th, 2010 | 16 | Yes |
Popular Name: N,N'-diethyl-N'-[2-(2-methylimidazol-1-yl)ethyl]ethane-1,2-diamine N,N'-diethyl-N'-[2-(2-methylimid…
None
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) | 0.30 | 7.24 | -124.06 | 3 | 4 | 2 | 39 | 226.368 | 8 | ↓ |
Hi High (pH 8-9.5) | 0.30 | 3.8 | -5.95 | 1 | 4 | 0 | 33 | 224.352 | 8 | ↓ |
Hi High (pH 8-9.5) | 0.30 | 5.16 | -45.98 | 2 | 4 | 1 | 38 | 225.36 | 8 | ↓ |
Mid Mid (pH 6-8) | 0.30 | 5.63 | -81.79 | 3 | 4 | 2 | 39 | 226.368 | 8 | ↓ |
Lo Low (pH 4.5-6) | 0.30 | 7.72 | -188.49 | 4 | 4 | 3 | 40 | 227.376 | 8 | ↓ |