| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 12th, 2006 | 23 | Yes |
Popular Name: 2-(4-hydroxyphenyl)-8-propylsulfanyl-5,7,9-triazabicyclo[4.4.0]deca-7,11-diene-4,10-dione 2-(4-hydroxyphenyl)-8-propylsulf…
| 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) | 2.48 | 4.02 | -10.82 | 3 | 6 | 0 | 95 | 331.397 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.11 | 2.05 | -41.8 | 2 | 6 | -1 | 101 | 330.389 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.11 | 2.53 | -28.15 | 3 | 6 | 0 | 103 | 331.397 | 4 | ↓ |
