| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 28th, 2010 | 16 | Yes |
Popular Name: 2-[2-(tert-butylamino)ethylsulfanyl]-6-methyl-1H-pyrimidin-4-one 2-[2-(tert-butylamino)ethylsulfa…
| 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) | 2.80 | 2.26 | -55.73 | 2 | 4 | 0 | 65 | 241.36 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.35 | 3.64 | -50.82 | 3 | 4 | 1 | 62 | 242.368 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.35 | 4.26 | -48.39 | 3 | 4 | 1 | 62 | 242.368 | 5 | ↓ |
