In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2010 | 19 | Yes |
Popular Name: 2-[1-[(3,4-dimethoxyphenyl)methyl]imidazol-2-yl]ethanamine 2-[1-[(3,4-dimethoxyphenyl)methy…
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) | 0.32 | 4.57 | -59.48 | 3 | 5 | 1 | 64 | 262.333 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.32 | 4.18 | -11.25 | 2 | 5 | 0 | 62 | 261.325 | 6 | ↓ |
Lo Low (pH 4.5-6) | 0.32 | 4.9 | -113.48 | 4 | 5 | 2 | 65 | 263.341 | 6 | ↓ |