In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 21st, 2011 | 22 | Yes |
Popular Name: 2-[(2-chloro-3,4-dimethoxy-phenyl)methyl]-3H-thieno[3,2-d]pyrimidin-4-one 2-[(2-chloro-3,4-dimethoxy-pheny…
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) | 3.26 | 6.16 | -16.02 | 1 | 5 | 0 | 64 | 336.8 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.72 | 4 | -53.74 | 0 | 5 | -1 | 67 | 335.792 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.