In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 27th, 2009 | 23 | Yes |
Popular Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-3-fluoro-4-methyl-benzamide N-[2-(3,4-dihydro-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) | 3.09 | 9.62 | -46.8 | 2 | 3 | 1 | 34 | 313.396 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.09 | 7.35 | -8.94 | 1 | 3 | 0 | 32 | 312.388 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.16 | 4.71 | -5.87 | 1 | 3 | 0 | 36 | 312.388 | 4 | ↓ |