In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 14 | Yes |
Popular Name: N-methyl-1-[5-(4-pyridyl)-1H-imidazol-2-yl]methanamine N-methyl-1-[5-(4-pyridyl)-1H-imi…
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) | -0.03 | 2.9 | -45.76 | 3 | 4 | 1 | 58 | 189.242 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.03 | 1.49 | -8.87 | 2 | 4 | 0 | 54 | 188.234 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.03 | 1.47 | -6.97 | 2 | 4 | 0 | 54 | 188.234 | 3 | ↓ |