In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 20th, 2006 | 29 | Yes |
Popular Name: 3,4-diethoxy-N-[3-(4-thia-1,6-diazabicyclo[3.3.0]octa-5,7-dien-7-yl)phenyl]-benzamide 3,4-diethoxy-N-[3-(4-thia-1,6-di…
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) | 3.71 | 10.54 | -26.92 | 1 | 6 | 0 | 65 | 409.511 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.71 | 10.98 | -34.87 | 2 | 6 | 1 | 67 | 410.519 | 7 | ↓ |