| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 22nd, 2006 | 17 | Yes |
Popular Name: 7-(3,4-dimethylphenyl)-3-methyl-4-thia-1,2,6-triazabicyclo[3.3.0]octa-2,5,7-triene 7-(3,4-dimethylphenyl)-3-methyl-…
| 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 | 8.11 | -12.11 | 0 | 3 | 0 | 30 | 243.335 | 1 | ↓ |
| Mid Mid (pH 6-8) | 2.91 | 8.55 | -26.4 | 1 | 3 | 1 | 31 | 244.343 | 1 | ↓ |
