| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 10th, 2006 | 22 | Yes |
Popular Name: 7-phenyl-3-(4-pyridylmethylene)-2-thia-5,6,8-triazabicyclo[3.3.0]octa-6,8-dien-4-one 7-phenyl-3-(4-pyridylmethylene)-…
| 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) | 2.50 | 7.94 | -15.45 | 0 | 5 | 0 | 60 | 306.35 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 2.50 | 8.23 | -55.54 | 1 | 5 | 1 | 61 | 307.358 | 2 | ↓ |
