| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 29th, 2007 | 20 | Yes |
Popular Name: 9-(3-chlorophenyl)-3-ethylsulfanyl-2,4,8,9-tetrazabicyclo[4.3.0]nona-1,3,5,7-tetraen-5-ol 9-(3-chlorophenyl)-3-ethylsulfan…
| 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) | 3.52 | 6.95 | -14.84 | 1 | 5 | 0 | 64 | 306.778 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.98 | 5.55 | -43.77 | 0 | 5 | -1 | 67 | 305.77 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.52 | 7.48 | -10.66 | 1 | 5 | 0 | 64 | 306.778 | 3 | ↓ |
