| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2005 | 20 | Yes |
Popular Name: N-[3-(4-thia-1,6-diazabicyclo[3.3.0]octa-5,7-dien-7-yl)phenyl]ethanesulfonamide N-[3-(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) | 2.03 | 4.97 | -17.6 | 1 | 5 | 0 | 64 | 309.416 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.03 | 5.13 | -57.89 | 0 | 5 | -1 | 66 | 308.408 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.03 | 5.41 | -41.25 | 2 | 5 | 1 | 65 | 310.424 | 4 | ↓ |
