| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 10th, 2010 | 28 | Yes |
Popular Name: 3-[[3-imidazol-1-ylpropyl(4-pyridylmethyl)amino]methyl]chromen-4-one 3-[[3-imidazol-1-ylpropyl(4-pyri…
| 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) | 1.61 | 12.7 | -99.72 | 2 | 6 | 2 | 67 | 376.46 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.61 | 12.18 | -57.8 | 1 | 6 | 1 | 65 | 375.452 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.61 | 10.1 | -17.11 | 0 | 6 | 0 | 64 | 374.444 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.61 | 10.62 | -40.26 | 1 | 6 | 1 | 65 | 375.452 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![3-[[3-imidazol-1-ylpropyl(4-pyridylmethyl)amino]methyl]chromone](http://zinc12.docking.org/img/rings/393450.gif)