| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 18th, 2009 | 23 | Yes |
Popular Name: 2-[(2-dimethylaminoethylamino)methyl]-6-phenyl-3H-thieno[2,3-d]pyrimidin-4-one 2-[(2-dimethylaminoethylamino)me…
| 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) | 2.36 | 6.72 | -50.07 | 3 | 5 | 1 | 62 | 329.449 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.36 | 3.8 | -20.99 | 2 | 5 | 0 | 61 | 328.441 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.81 | 4.15 | -62.7 | 2 | 5 | 0 | 65 | 328.441 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.36 | 7.64 | -136.31 | 4 | 5 | 2 | 67 | 330.457 | 6 | ↓ |
