In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 30th, 2009 | 27 | Yes |
Popular Name: N-[(2S)-2-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]-2-(3-fluoro-4-methoxy-phenyl)acetamide N-[(2S)-2-(3,4-dihydro-1H-isoqui…
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) | 3.66 | 10.45 | -55.79 | 2 | 4 | 1 | 43 | 371.476 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.66 | 8.27 | -14.22 | 1 | 4 | 0 | 42 | 370.468 | 7 | ↓ |