| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 5th, 2010 | 18 | Yes |
Popular Name: 2-[(1S)-2-amino-1-phenyl-ethyl]sulfanyl-6-methyl-1H-pyrimidin-4-one 2-[(1S)-2-amino-1-phenyl-ethyl]s…
| 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) | 2.22 | 2.18 | -48.15 | 2 | 4 | -1 | 75 | 260.342 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.76 | 3.94 | -8.8 | 3 | 4 | 0 | 72 | 261.35 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.76 | 4.31 | -59.44 | 4 | 4 | 1 | 73 | 262.358 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.22 | 2.52 | -69.18 | 3 | 4 | 0 | 76 | 261.35 | 4 | ↓ |
