| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 6th, 2010 | 21 | Yes |
Popular Name: 2-[(1S)-2-amino-1-(4-fluorophenyl)ethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one 2-[(1S)-2-amino-1-(4-fluoropheny…
| 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) | 3.46 | 3.81 | -46.38 | 2 | 4 | -1 | 75 | 306.386 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.00 | 5.44 | -9.8 | 3 | 4 | 0 | 72 | 307.394 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.00 | 5.8 | -64.37 | 4 | 4 | 1 | 73 | 308.402 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.46 | 4.15 | -71.48 | 3 | 4 | 0 | 76 | 307.394 | 6 | ↓ |
