| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 23rd, 2006 | 22 | Yes |
Popular Name: 7-(4-chlorophenyl)-4-sec-butylsulfanyl-3,5,7,8-tetrazabicyclo[4.3.0]nona-3,5,9-trien-2-one 7-(4-chlorophenyl)-4-sec-butylsu…
| 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) | 4.66 | 7.47 | -42.45 | 0 | 5 | -1 | 67 | 333.824 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.20 | 8.87 | -12.57 | 1 | 5 | 0 | 64 | 334.832 | 4 | ↓ |
