In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 25th, 2009 | 22 | Yes |
Popular Name: 3-[5-(1,3-benzodioxole-5-carbonylamino)-1,3,4-thiadiazol-2-yl]propanoic 3-[5-(1,3-benzodioxole-5-carbony…
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) | 0.86 | 5.06 | -54.83 | 1 | 8 | -1 | 113 | 320.306 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.93 | 3.4 | -100.09 | 0 | 8 | -2 | 120 | 319.298 | 5 | ↓ |