| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 5th, 2010 | 20 | Yes |
Popular Name: 2-[(1S)-2-amino-1-phenyl-ethyl]sulfanyl-6-propyl-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) | 3.29 | 3.74 | -48.03 | 2 | 4 | -1 | 75 | 288.396 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.84 | 5.36 | -8.19 | 3 | 4 | 0 | 72 | 289.404 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.84 | 5.74 | -59.04 | 4 | 4 | 1 | 73 | 290.412 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.29 | 4.09 | -68.88 | 3 | 4 | 0 | 76 | 289.404 | 6 | ↓ |
