| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 31st, 2011 | 22 | Yes |
Popular Name: (2S)-1-[4-[(5-ethoxy-1,3,4-thiadiazol-2-yl)methyl]piperazin-1-yl]-3,3-dimethyl-butan-2-ol (2S)-1-[4-[(5-ethoxy-1,3,4-thiad…
| 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) | 1.57 | -0.93 | -6.83 | 1 | 6 | 0 | 62 | 328.482 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.57 | 1.39 | -40.25 | 2 | 6 | 1 | 63 | 329.49 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
