In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 20 | Yes |
Popular Name: N,N-diethyl-N'-[(4-imidazol-1-ylphenyl)methyl]ethane-1,2-diamine N,N-diethyl-N'-[(4-imidazol-1-yl…
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) | 1.61 | 8.18 | -50.02 | 2 | 4 | 1 | 38 | 273.404 | 8 | ↓ |
Mid Mid (pH 6-8) | 1.61 | 8.94 | -39.1 | 2 | 4 | 1 | 34 | 273.404 | 8 | ↓ |
Mid Mid (pH 6-8) | 1.61 | 9.45 | -73.18 | 3 | 4 | 2 | 36 | 274.412 | 8 | ↓ |
Lo Low (pH 4.5-6) | 1.61 | 10.81 | -173.78 | 4 | 4 | 3 | 40 | 275.42 | 8 | ↓ |