In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 31st, 2008 | 17 | No |
Popular Name: 1-[(5-methyl-2-thioxo-1,3,4-thiadiazol-3-yl)methyl]piperidine-4-carboxamide 1-[(5-methyl-2-thioxo-1,3,4-thia…
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) | -0.38 | 1.82 | -18.59 | 2 | 5 | 0 | 64 | 272.399 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.38 | 4.16 | -45.76 | 3 | 5 | 1 | 65 | 273.407 | 3 | ↓ |