In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2010 | 20 | Yes |
Popular Name: 1-[2-[(4-bromo-2-thienyl)methylamino]-2-oxo-ethyl]cyclohexanecarboxylic 1-[2-[(4-bromo-2-thienyl)methyla…
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) | 2.96 | 8.21 | -56.34 | 1 | 4 | -1 | 69 | 359.265 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.96 | 6.24 | -12.4 | 2 | 4 | 0 | 66 | 360.273 | 5 | ↓ |