In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 20th, 2006 | 25 | Yes |
Popular Name: 3-methyl-N-[3-(4-thia-1,6-diazabicyclo[3.3.0]octa-5,7-dien-7-yl)phenyl]-benzenesulfonamide 3-methyl-N-[3-(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) | 3.61 | -4.64 | -23.39 | 1 | 5 | 0 | 63 | 371.487 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.61 | -4.06 | -67.38 | 0 | 5 | -1 | 66 | 370.479 | 4 | ↓ |