| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2010 | 28 | Yes |
Popular Name: N-[(1R)-1-(benzofuran-2-yl)ethyl]-1-oxo-N-propyl-2H-isoquinoline-3-carboxamide N-[(1R)-1-(benzofuran-2-yl)ethyl…
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| 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) | 4.79 | 10.26 | -13.66 | 1 | 5 | 0 | 66 | 374.44 | 5 | ↓ |
| Hi High (pH 8-9.5) | 5.25 | 10.37 | -46.59 | 0 | 5 | -1 | 69 | 373.432 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
