| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 6th, 2008 | 31 | Yes |
| 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) | 3.14 | 10.56 | -18.18 | 1 | 7 | 0 | 81 | 409.449 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.14 | 11.01 | -50.59 | 2 | 7 | 1 | 83 | 410.457 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![4-[(ketoBLAHyl)methyl]-N-(3-pyridylmethyl)benzamide](http://zinc12.docking.org/img/rings/84007.gif)