In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 14th, 2010 | 26 | Yes |
Popular Name: 4-bromo-N-[2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethylamino]-2-oxo-ethyl]benzamide 4-bromo-N-[2-[2-(3,4-dihydro-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) | 2.97 | 5.75 | -10.53 | 2 | 5 | 0 | 61 | 416.319 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.97 | 8.02 | -50.17 | 3 | 5 | 1 | 63 | 417.327 | 6 | ↓ |