In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2005 | 24 | Yes |
Popular Name: N-[3-(4-thia-1,6-diazabicyclo[3.3.0]octa-5,7-dien-7-yl)phenyl]pyridine-3-sulfonamide 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) | 2.12 | -5.8 | -19.57 | 1 | 6 | 0 | 76 | 358.448 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.12 | -5.23 | -58.21 | 0 | 6 | -1 | 78 | 357.44 | 4 | ↓ |