In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 27th, 2010 | 13 | Yes |
Popular Name: N-methyl-N-[2-(2-methylimidazol-1-yl)ethyl]ethane-1,2-diamine N-methyl-N-[2-(2-methylimidazol-…
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) | -1.08 | 2 | -83.35 | 4 | 4 | 2 | 50 | 184.287 | 5 | ↓ |
Hi High (pH 8-9.5) | -1.08 | 1.52 | -49.21 | 3 | 4 | 1 | 49 | 183.279 | 5 | ↓ |
Lo Low (pH 4.5-6) | -1.08 | 4.3 | -187.22 | 5 | 4 | 3 | 51 | 185.295 | 5 | ↓ |