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]benzenesulfonamide 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) | 3.21 | -4.96 | -19.77 | 1 | 5 | 0 | 63 | 357.46 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.21 | -4.38 | -56.32 | 0 | 5 | -1 | 66 | 356.452 | 4 | ↓ |