In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 21st, 2009 | 14 | Yes |
Popular Name: (1R)-1-[5-(5-bromo-2-thienyl)-1H-imidazol-2-yl]ethanamine (1R)-1-[5-(5-bromo-2-thienyl)-1H…
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) | 0.29 | 3.17 | -45.34 | 4 | 3 | 1 | 56 | 273.179 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.29 | 2.9 | -6.34 | 3 | 3 | 0 | 55 | 272.171 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.29 | 2.87 | -4.74 | 3 | 3 | 0 | 55 | 272.171 | 2 | ↓ |