In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 14th, 2008 | 23 | Yes |
Popular Name: (7R)-7-methyl-3-[2-(2-pyridyl)ethyl]-5,6,7,8-tetrahydrobenzothiopheno[3,2-e]pyrimidin-4-one (7R)-7-methyl-3-[2-(2-pyridyl)et…
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) | 3.10 | 10.52 | -15.74 | 0 | 4 | 0 | 48 | 325.437 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.10 | 10.9 | -42.3 | 1 | 4 | 1 | 49 | 326.445 | 3 | ↓ |