In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 25th, 2008 | 20 | Yes |
Popular Name: 4-[(2,4-diaminopyrimidin-5-yl)methyl]-2,6-dimethoxy-phenol 4-[(2,4-diaminopyrimidin-5-yl)me…
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) | 0.72 | 2.3 | -13.66 | 5 | 7 | 0 | 117 | 276.296 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.72 | 2.6 | -42 | 6 | 7 | 1 | 118 | 277.304 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.72 | -1.11 | -40.38 | 6 | 7 | 1 | 118 | 277.304 | 4 | ↓ |