| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 8th, 2010 | 17 | Yes |
Popular Name: N-[[2-[(1R,3S)-3-methylcyclohexyl]pyrimidin-4-yl]methyl]ethanamine N-[[2-[(1R,3S)-3-methylcyclohexy…
| 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) | 2.19 | 6.92 | -40.12 | 2 | 3 | 1 | 42 | 234.367 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.19 | 5.55 | -4.08 | 1 | 3 | 0 | 38 | 233.359 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
