In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2005 | 19 | Yes |
Popular Name: 4-[(4-fluorophenyl)methylsulfanyl]-3,5,7,8-tetrazabicyclo[4.3.0]nona-4,8,10-trien-2-one 4-[(4-fluorophenyl)methylsulfany…
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) | 2.70 | -2.6 | -10.41 | 2 | 5 | 0 | 74 | 276.296 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.16 | 3.58 | -45.25 | 1 | 5 | -1 | 78 | 275.288 | 3 | ↓ |