In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 23rd, 2010 | 19 | Yes |
Popular Name: 2-[[5-[methyl(3-pyridylmethyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]acetic 2-[[5-[methyl(3-pyridylmethyl)am…
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) | 0.89 | 6.51 | -52.13 | 0 | 6 | -1 | 82 | 295.369 | 6 | ↓ |
Lo Low (pH 4.5-6) | 0.89 | 6.98 | -63.69 | 1 | 6 | 0 | 83 | 296.377 | 6 | ↓ |