| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 28th, 2009 | 30 | Yes |
Popular Name: [2-(3,4-dimethylphenyl)sulfanyl-3-pyridyl]-[4-(4-pyridylmethyl)piperazin-1-yl]methanone [2-(3,4-dimethylphenyl)sulfanyl-…
| 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) | 2.91 | 9.58 | -15.16 | 0 | 5 | 0 | 49 | 418.566 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.91 | 11.91 | -58.19 | 1 | 5 | 1 | 51 | 419.574 | 5 | ↓ |
