In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2010 | 20 | No |
Popular Name: (8aR)-2-(pyrrolidin-1-ylmethyl)-6,7,8,8a-tetrahydro-5H-benzothiopheno[2,3-d]pyrimidin-4-one (8aR)-2-(pyrrolidin-1-ylmethyl)-…
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) | 1.97 | 5.35 | -13.89 | 0 | 4 | 0 | 46 | 289.404 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.97 | 7.86 | -34.74 | 1 | 4 | 1 | 47 | 290.412 | 2 | ↓ |