In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 2nd, 2009 | 23 | Yes |
Popular Name: N-[(2S)-2-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-6-methyl-pyridine-2-carboxamide 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) | 1.77 | 8.54 | -41.83 | 2 | 4 | 1 | 46 | 310.421 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.77 | 6.38 | -9.12 | 1 | 4 | 0 | 45 | 309.413 | 4 | ↓ |