| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 8th, 2010 | 21 | Yes |
Popular Name: N-[[2-(azepan-1-yl)-4,6-dimethyl-pyrimidin-5-yl]methyl]-2-methoxy-ethanamine N-[[2-(azepan-1-yl)-4,6-dimethyl…
| 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) | 2.52 | 8.92 | -42.92 | 2 | 5 | 1 | 55 | 293.435 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.52 | 7.48 | -7.43 | 1 | 5 | 0 | 50 | 292.427 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.52 | 9.23 | -94.67 | 3 | 5 | 2 | 56 | 294.443 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
