| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 18th, 2009 | 21 | Yes |
Popular Name: 2-[(2-diethylaminoethylamino)methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one 2-[(2-diethylaminoethylamino)met…
| 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) | 1.79 | 5.7 | -44.46 | 3 | 5 | 1 | 62 | 309.459 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.25 | 4.04 | -45.33 | 2 | 5 | 0 | 69 | 308.451 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.79 | 3.58 | -10.03 | 2 | 5 | 0 | 61 | 308.451 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.79 | 6.65 | -133.45 | 4 | 5 | 2 | 67 | 310.467 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.79 | 4.53 | -57.98 | 3 | 5 | 1 | 66 | 309.459 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.79 | 3.14 | -17.44 | 2 | 5 | 0 | 61 | 308.451 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.79 | 7.08 | -133.51 | 4 | 5 | 2 | 67 | 310.467 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.79 | 4.93 | -55.09 | 3 | 5 | 1 | 66 | 309.459 | 7 | ↓ |
