| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 25th, 2007 | 30 | Yes |
Popular Name: 4-phenyl-N-[4-(4-thia-1,6-diazabicyclo[3.3.0]octa-5,7-dien-7-yl)phenyl]-benzenesulfonamide 4-phenyl-N-[4-(4-thia-1,6-diazab…
| 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) | 5.01 | -4.42 | -19.99 | 1 | 5 | 0 | 64 | 433.558 | 5 | ↓ |
| Hi High (pH 8-9.5) | 5.01 | -3.59 | -55.26 | 1 | 5 | 0 | 67 | 433.558 | 5 | ↓ |
| Hi High (pH 8-9.5) | 5.01 | -3.84 | -56.29 | 0 | 5 | -1 | 66 | 432.55 | 5 | ↓ |
| Mid Mid (pH 6-8) | 5.01 | -4.17 | -38.77 | 2 | 5 | 1 | 65 | 434.566 | 5 | ↓ |
