| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 15th, 2011 | 27 | No |
Popular Name: N-[(1R)-1-(3-ethoxyphenyl)ethyl]-N'-(5-isoquinolyl)oxamide N-[(1R)-1-(3-ethoxyphenyl)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) | 2.65 | 6.55 | -9.57 | 2 | 6 | 0 | 80 | 363.417 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.84 | 5.79 | -48.63 | 1 | 6 | -1 | 87 | 362.409 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.65 | 7.01 | -40.76 | 3 | 6 | 1 | 82 | 364.425 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
