| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 14th, 2008 | 22 | No |
Popular Name: (1E)-1-[4-(methoxymethyl)-6-oxo-3H-pyrimidin-2-ylidene]-3-(4-methoxyphenyl)guanidine (1E)-1-[4-(methoxymethyl)-6-oxo-…
| 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) | 1.12 | 6.27 | -14.01 | 4 | 8 | 0 | 115 | 303.322 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.58 | 4.35 | -53.44 | 3 | 8 | -1 | 118 | 302.314 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.68 | 6.44 | -39.25 | 5 | 8 | 1 | 114 | 304.33 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.12 | 6.24 | -19.04 | 4 | 8 | 0 | 115 | 303.322 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.58 | 4.77 | -53.38 | 3 | 8 | -1 | 118 | 302.314 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
