| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 7th, 2006 | 22 | Yes |
Popular Name: 9-methyl-2-(4-tert-butylphenyl)-8-thia-3,6-diazabicyclo[5.3.0]deca-1,6,9-trien-5-one 9-methyl-2-(4-tert-butylphenyl)-…
| 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) | 3.90 | 6.96 | -7.86 | 1 | 3 | 0 | 41 | 312.438 | 2 | ↓ |
| Mid Mid (pH 6-8) | 3.90 | 7.79 | -30.65 | 2 | 3 | 1 | 43 | 313.446 | 2 | ↓ |
