| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 21st, 2010 | 20 | Yes |
Popular Name: 1-(2-Methyl-6-oxo-1,6-dihydro-pyrimidin-4-ylmethyl)-piperidine-4-carboxylic acid ethyl ester 1-(2-Methyl-6-oxo-1,6-dihydro-py…
| 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) | 0.82 | 3.62 | -23.84 | 1 | 6 | 0 | 75 | 279.34 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.28 | 4.76 | -59.61 | 1 | 6 | 0 | 80 | 279.34 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.82 | 4.82 | -13.53 | 1 | 6 | 0 | 75 | 279.34 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.82 | 5.86 | -72.08 | 2 | 6 | 1 | 76 | 280.348 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
