| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 20th, 2006 | 24 | Yes |
Popular Name: N-[4-(4-thia-1,6-diazabicyclo[3.3.0]octa-5,7-dien-7-yl)phenyl]pyridine-3-sulfonamide N-[4-(4-thia-1,6-diazabicyclo[3.…
| 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) | 2.14 | 5.62 | -57.72 | 0 | 6 | -1 | 79 | 357.44 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.14 | 5.49 | -19.71 | 1 | 6 | 0 | 77 | 358.448 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.14 | 5.93 | -39.78 | 2 | 6 | 1 | 78 | 359.456 | 4 | ↓ |
