| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 19th, 2011 | 25 | Yes |
Popular Name: N-(3,3-dimethylbutyl)-3-[4-methyl-6-oxo-2-(4-pyridyl)-1H-pyrimidin-5-yl]propanamide N-(3,3-dimethylbutyl)-3-[4-methy…
| 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) | 2.43 | 6.17 | -14.32 | 2 | 6 | 0 | 88 | 342.443 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.89 | 4.32 | -50.91 | 1 | 6 | -1 | 91 | 341.435 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.43 | 6.62 | -52.64 | 3 | 6 | 1 | 89 | 343.451 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
