In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 29 | Yes |
Popular Name: 2-[(1R)-2-acetyl-1H-isoquinolin-1-yl]-N-[(1S)-1-[3-(trifluoromethyl)phenyl]ethyl]acetamide 2-[(1R)-2-acetyl-1H-isoquinolin-…
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) | 3.51 | 12.3 | -15.82 | 1 | 4 | 0 | 49 | 402.416 | 5 | ↓ |