| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2010 | 16 | No |
Popular Name: 1-(2-chloro-6-methyl-pyrimidin-4-yl)-4-methyl-1,4-diazepane 1-(2-chloro-6-methyl-pyrimidin-4…
| 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) | 1.84 | 7.62 | -45.12 | 1 | 4 | 1 | 33 | 241.746 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.84 | 5.63 | -6.44 | 0 | 4 | 0 | 32 | 240.738 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
