| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 1st, 2009 | 17 | Yes |
Popular Name: 2-[[[(1S)-2-methoxy-1-methyl-ethyl]amino]methyl]-3H-thieno[3,2-d]pyrimidin-4-one 2-[[[(1S)-2-methoxy-1-methyl-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) | 1.18 | 0.07 | -46.52 | 2 | 5 | 0 | 75 | 253.327 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.18 | -1.17 | -49.92 | 1 | 5 | -1 | 70 | 252.319 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.72 | 1.46 | -12.91 | 2 | 5 | 0 | 67 | 253.327 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.72 | 2.7 | -50.94 | 3 | 5 | 1 | 72 | 254.335 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.72 | 0.91 | -24 | 2 | 5 | 0 | 67 | 253.327 | 5 | ↓ |
