| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 8th, 2010 | 18 | Yes |
Popular Name: N-[[2-(2-diethylaminoethyl)pyrimidin-5-yl]methyl]cyclopropanamine N-[[2-(2-diethylaminoethyl)pyrim…
| 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) | 0.82 | 7.23 | -85.35 | 3 | 4 | 2 | 47 | 250.39 | 8 | ↓ |
| Hi High (pH 8-9.5) | 0.82 | 5.11 | -42.97 | 2 | 4 | 1 | 46 | 249.382 | 8 | ↓ |
| Hi High (pH 8-9.5) | 0.82 | 3.77 | -4.31 | 1 | 4 | 0 | 41 | 248.374 | 8 | ↓ |
| Hi High (pH 8-9.5) | 0.82 | 5.94 | -32.03 | 2 | 4 | 1 | 42 | 249.382 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
