| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 10th, 2006 | 23 | Yes |
Popular Name: 7-(p-tolyl)-3-(4-pyridylmethylene)-2-thia-5,6,8-triazabicyclo[3.3.0]octa-6,8-dien-4-one 7-(p-tolyl)-3-(4-pyridylmethylen…
| 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) | 2.94 | 8.62 | -15.16 | 0 | 5 | 0 | 60 | 320.377 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 2.94 | 8.91 | -55.32 | 1 | 5 | 1 | 61 | 321.385 | 2 | ↓ |
