In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 8th, 2007 | 22 | Yes |
Popular Name: N-(5-isopropyl-3H-1,3,4-thiadiazol-2-ylidene)-2-(2,3,6-trimethylphenoxy)-acetamide N-(5-isopropyl-3H-1,3,4-thiadiaz…
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) | 3.49 | 8.87 | -20.16 | 1 | 5 | 0 | 64 | 319.43 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.67 | 7.79 | -49.51 | 0 | 5 | -1 | 70 | 318.422 | 5 | ↓ |