In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 17th, 2005 | 25 | Yes |
Popular Name: 3-fluoro-N-(8-phenyl-1,7-diazabicyclo[4.3.0]nona-2,4,6,8-tetraen-9-yl)-benzamide 3-fluoro-N-(8-phenyl-1,7-diazabi…
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) | 4.13 | 11.65 | -16.15 | 1 | 4 | 0 | 46 | 331.35 | 3 | ↓ |
Lo Low (pH 4.5-6) | 4.13 | 12 | -29.58 | 2 | 4 | 1 | 48 | 332.358 | 3 | ↓ |