| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2008 | 27 | Yes |
Popular Name: (5S)-2-allylsulfanyl-5-(4-butoxyphenyl)-3,5,6,8-tetrahydropyrido[5,6-e]pyrimidine-4,7-dione (5S)-2-allylsulfanyl-5-(4-butoxy…
| 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) | 4.22 | 8.46 | -10.21 | 2 | 6 | 0 | 84 | 385.489 | 8 | ↓ |
| Mid Mid (pH 6-8) | 4.22 | 7.92 | -15.88 | 2 | 6 | 0 | 84 | 385.489 | 8 | ↓ |
| Mid Mid (pH 6-8) | 4.68 | 6.52 | -41.5 | 1 | 6 | -1 | 87 | 384.481 | 8 | ↓ |
