| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 26th, 2011 | 23 | No |
Popular Name: 1-[[5-(3,5-dimethylphenyl)-2-thioxo-1,3,4-oxadiazol-3-yl]methyl]piperidine-4-carbonitrile 1-[[5-(3,5-dimethylphenyl)-2-thi…
| 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) | 3.06 | 6.42 | -12.23 | 0 | 5 | 0 | 58 | 328.441 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.06 | 8.85 | -50.21 | 1 | 5 | 1 | 59 | 329.449 | 3 | ↓ |
