In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 10th, 2010 | 26 | Yes |
Popular Name: N-[[6-(3,4-dihydro-1H-isoquinolin-2-yl)-3-pyridyl]methyl]pyridine-3-carboxamide N-[[6-(3,4-dihydro-1H-isoquinoli…
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) | 1.89 | 9.16 | -40.42 | 2 | 5 | 1 | 59 | 345.426 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.89 | 8.8 | -11.1 | 1 | 5 | 0 | 58 | 344.418 | 4 | ↓ |