| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2010 | 18 | Yes |
Popular Name: 1-[(2-methylpyrimidin-4-yl)amino]cycloheptanecarboxylic 1-[(2-methylpyrimidin-4-yl)amino…
| 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) | -0.17 | 6.3 | -45.2 | 1 | 5 | -1 | 78 | 248.306 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.17 | 6.75 | -39.83 | 2 | 5 | 0 | 79 | 249.314 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
