| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 8th, 2011 | 27 | No |
| 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) | -0.41 | 0.84 | -18.26 | 1 | 8 | 0 | 87 | 391.497 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.23 | -1.48 | -54.45 | 0 | 8 | -1 | 93 | 390.489 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![N-[4-(morpholinomethyl)-3-thiazolin-2-yl]-5-(pyrrolidine-1-carbonyl)-2H-pyrrole-3-carboxamide](http://zinc12.docking.org/img/rings/359459.gif)