In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 8th, 2008 | 32 | Yes |
Popular Name: 2-[4-[2-(2-fluorophenoxy)acetyl]piperazin-1-yl]-N-(5-phenyl-1,3,4-thiadiazol-2-yl)acetamide 2-[4-[2-(2-fluorophenoxy)acetyl]…
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) | 3.16 | 8.37 | -33.96 | 1 | 8 | 0 | 88 | 455.515 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.98 | 7.44 | -51.54 | 0 | 8 | -1 | 94 | 454.507 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.16 | 10.72 | -70.32 | 2 | 8 | 1 | 89 | 456.523 | 7 | ↓ |