| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 6th, 2011 | 18 | No |
Popular Name: (1E)-4-(2-hydroxyethyl)-N-phenyl-piperazine-1-carboximidothioic (1E)-4-(2-hydroxyethyl)-N-phenyl…
| 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) | -2.69 | 5.36 | -45.91 | 3 | 4 | 1 | 40 | 266.39 | 4 | ↓ |
| Mid Mid (pH 6-8) | -2.69 | 3.07 | -10.79 | 2 | 4 | 0 | 38 | 265.382 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
