In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 10th, 2006 | 27 | Yes |
Popular Name: (5-methyl-1,3,4-thiadiazol-2-yl)-(4-pyridyl)BLAHdione (5-methyl-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) | 1.68 | 8.44 | -13.2 | 0 | 7 | 0 | 89 | 376.397 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.68 | 8.72 | -38.08 | 1 | 7 | 1 | 90 | 377.405 | 2 | ↓ |