In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 29th, 2008 | 32 | Yes |
Popular Name: [5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanylmethylBLAHone [5-(3,4,5-trimethoxyphenyl)-1,3,…
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) | 3.32 | 4.2 | -16.75 | 1 | 9 | 0 | 112 | 472.548 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.78 | 1.75 | -50.13 | 0 | 9 | -1 | 115 | 471.54 | 7 | ↓ |