| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 12th, 2008 | 19 | Yes |
Popular Name: 2-[2-[(1S)-1-aminoethyl]-3-fluoro-phenyl]sulfanyl-6-methyl-1H-pyrimidin-4-one 2-[2-[(1S)-1-aminoethyl]-3-fluor…
| 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) | 0.28 | 3.76 | -40.17 | 4 | 4 | 1 | 73 | 280.348 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.74 | 2.7 | -40.65 | 2 | 4 | -1 | 75 | 278.332 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.74 | 2.96 | -35.21 | 3 | 4 | 0 | 76 | 279.34 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.28 | 3.35 | -42.56 | 4 | 4 | 1 | 73 | 280.348 | 3 | ↓ |
