| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 14th, 2008 | 21 | Yes |
Popular Name: 7-[(4-bromophenyl)methoxy]isoquinoline-1-carbonitrile 7-[(4-bromophenyl)methoxy]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) | 4.48 | 9.06 | -12.84 | 0 | 3 | 0 | 46 | 339.192 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 4.48 | 9.34 | -42.07 | 1 | 3 | 1 | 47 | 340.2 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
