| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2011 | 16 | Yes |
Popular Name: (2S)-2-[4-(1,3,4-thiadiazol-2-yl)piperazin-1-yl]butan-1-amine (2S)-2-[4-(1,3,4-thiadiazol-2-yl…
| 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) | 0.32 | 1.69 | -51.96 | 3 | 5 | 1 | 60 | 242.372 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.32 | 3.48 | -137.78 | 4 | 5 | 2 | 61 | 243.38 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
