In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2011 | 14 | Yes |
Popular Name: 2-[4-(1,3,4-thiadiazol-2-yl)piperazin-1-yl]ethanamine 2-[4-(1,3,4-thiadiazol-2-yl)pipe…
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) | -0.55 | 0.23 | -51.52 | 3 | 5 | 1 | 60 | 214.318 | 3 | ↓ |
Lo Low (pH 4.5-6) | -0.55 | 2.44 | -130.3 | 4 | 5 | 2 | 61 | 215.326 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.