| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 3rd, 2010 | 21 | Yes |
Popular Name: 2-[[4-[isopropyl(methyl)amino]butylamino]methyl]-3H-thieno[3,2-d]pyrimidin-4-one 2-[[4-[isopropyl(methyl)amino]bu…
| 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) | 2.11 | 4.36 | -92.36 | 3 | 5 | 1 | 70 | 309.459 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.65 | 5.09 | -51 | 3 | 5 | 1 | 62 | 309.459 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.65 | 7 | -113.39 | 4 | 5 | 2 | 67 | 310.467 | 8 | ↓ |
