| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 18th, 2009 | 18 | Yes |
Popular Name: 2-[[[(2S)-2-hydroxypropyl]amino]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one 2-[[[(2S)-2-hydroxypropyl]amino]…
| 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) | 0.74 | 1.94 | -52.48 | 4 | 5 | 1 | 83 | 268.362 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.20 | 0.92 | -45.19 | 3 | 5 | 0 | 86 | 267.354 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.74 | 0.46 | -14.88 | 3 | 5 | 0 | 78 | 267.354 | 4 | ↓ |
