| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 18th, 2009 | 23 | Yes |
Popular Name: 2-[[[(1R)-1-(hydroxymethyl)propyl]amino]methyl]-6-phenyl-3H-thieno[2,3-d]pyrimidin-4-one 2-[[[(1R)-1-(hydroxymethyl)propy…
| 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) | 2.56 | 4.74 | -56.38 | 4 | 5 | 1 | 83 | 330.433 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.02 | 3.67 | -46.28 | 3 | 5 | 0 | 86 | 329.425 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.56 | 2.98 | -21.15 | 3 | 5 | 0 | 78 | 329.425 | 6 | ↓ |
