| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 5th, 2009 | 22 | Yes |
Popular Name: 3-[[methyl-[(4-oxo-3H-thieno[3,2-d]pyrimidin-2-yl)methyl]amino]methyl]benzonitrile 3-[[methyl-[(4-oxo-3H-thieno[3,2…
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| 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) | 2.24 | 5.6 | -58.84 | 1 | 5 | 0 | 77 | 310.382 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.78 | 8.46 | -65.09 | 2 | 5 | 1 | 74 | 311.39 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.78 | 6.15 | -16.75 | 1 | 5 | 0 | 73 | 310.382 | 4 | ↓ |
