| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 24th, 2009 | 27 | Yes |
Popular Name: 5-(3,4-dimethylphenyl)-2-[(4-ethylpiperazin-1-yl)methyl]-3H-thieno[2,3-d]pyrimidin-4-one 5-(3,4-dimethylphenyl)-2-[(4-eth…
| 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) | 3.47 | 9.49 | -45.23 | 2 | 5 | 1 | 53 | 383.541 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.47 | 9.45 | -50.62 | 2 | 5 | 1 | 53 | 383.541 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.47 | 7.2 | -11.66 | 1 | 5 | 0 | 52 | 382.533 | 4 | ↓ |
