| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2011 | 24 | Yes |
Popular Name: 2-[(1S)-1-(7-ethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-5-isobutyl-1,3,4-oxadiazole 2-[(1S)-1-(7-ethoxy-3,4-dihydro-…
| 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) | 2.46 | 4.43 | -10.78 | 0 | 5 | 0 | 51 | 329.444 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.46 | 6.34 | -39.02 | 1 | 5 | 1 | 53 | 330.452 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
