In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2011 | 13 | Yes |
Popular Name: 2-[1-(1,3,4-thiadiazol-2-yl)imidazol-2-yl]ethanamine 2-[1-(1,3,4-thiadiazol-2-yl)imid…
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) | -0.50 | 2.29 | -42.64 | 3 | 5 | 1 | 71 | 196.259 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.50 | 1.91 | -10.67 | 2 | 5 | 0 | 70 | 195.251 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.