In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 8th, 2008 | 32 | Yes |
Popular Name: 2-(4-(2-(4-chlorophenoxy)acetyl)piperazin-1-yl)-N-(5-phenyl-1,3,4-thiadiazol-2-yl)acetamide 2-(4-(2-(4-chlorophenoxy)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) | 3.72 | 8.83 | -28.9 | 1 | 8 | 0 | 88 | 471.97 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.54 | 7.9 | -47.31 | 0 | 8 | -1 | 94 | 470.962 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.72 | 11.18 | -67 | 2 | 8 | 1 | 89 | 472.978 | 7 | ↓ |