In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 6th, 2009 | 19 | No |
Popular Name: 2-[[2-[(5-bromo-2-thienyl)methyl-ethyl-amino]-2-oxo-ethyl]-methyl-amino]acetic 2-[[2-[(5-bromo-2-thienyl)methyl…
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) | 0.63 | 8.61 | -37.37 | 1 | 5 | 0 | 65 | 349.25 | 7 | ↓ |
Hi High (pH 8-9.5) | 0.63 | 6.41 | -50.15 | 0 | 5 | -1 | 64 | 348.242 | 7 | ↓ |