| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 25th, 2011 | 21 | Yes |
Popular Name: (2S)-1-[4-(4-methoxypyrimidin-2-yl)-1,4-diazepan-1-yl]-2-methyl-butan-1-one (2S)-1-[4-(4-methoxypyrimidin-2-…
| 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) | 2.26 | 7.73 | -9.26 | 0 | 6 | 0 | 59 | 292.383 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.26 | 8.11 | -41.34 | 1 | 6 | 1 | 60 | 293.391 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
