| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 17th, 2010 | 21 | Yes |
Popular Name: 2-[[[1-(hydroxymethyl)-4-methyl-cyclohexyl]amino]methyl]-3H-thieno[3,2-d]pyrimidin-4-one 2-[[[1-(hydroxymethyl)-4-methyl-…
| 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) | 1.52 | 2.96 | -48.44 | 4 | 5 | 1 | 83 | 308.427 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.98 | 0.34 | -45.11 | 3 | 5 | 0 | 86 | 307.419 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.52 | 1.17 | -24.36 | 3 | 5 | 0 | 78 | 307.419 | 4 | ↓ |
