In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2009 | 22 | Yes |
Popular Name: 3-amino-N-[6-(3,4-dihydro-1H-isoquinolin-2-yl)-3-pyridyl]propanamide 3-amino-N-[6-(3,4-dihydro-1H-iso…
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) | 0.96 | 4.32 | -57.27 | 4 | 5 | 1 | 73 | 297.382 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.96 | 4.57 | -101.36 | 5 | 5 | 2 | 74 | 298.39 | 4 | ↓ |