| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 8th, 2011 | 29 | No |
Popular Name: N'-[4-(diallylcarbamoyl)phenyl]-N-[(1R)-1-(4-pyridyl)ethyl]oxamide N'-[4-(diallylcarbamoyl)phenyl]-…
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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) | 1.15 | 6.77 | -11.65 | 2 | 7 | 0 | 91 | 392.459 | 9 | ↓ |
| Hi High (pH 8-9.5) | 1.33 | 5.99 | -49.23 | 1 | 7 | -1 | 98 | 391.451 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 1.15 | 7.23 | -44.96 | 3 | 7 | 1 | 93 | 393.467 | 9 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
