In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 10th, 2007 | 38 | Yes |
Popular Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-dimethoxy-oxo-BLAHcarboxamide 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) | 2.41 | 12.26 | -68.43 | 2 | 7 | 1 | 72 | 512.63 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.41 | 9.99 | -19.57 | 1 | 7 | 0 | 71 | 511.622 | 6 | ↓ |