In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2008 | 25 | Yes |
Popular Name: 3-[(4-oxo-5,6,7,8-tetrahydro-3H-benzothiopheno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]benzoic 3-[(4-oxo-5,6,7,8-tetrahydro-3H-…
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) | 4.88 | 9.64 | -60.24 | 1 | 5 | -1 | 86 | 371.463 | 4 | ↓ |
Hi High (pH 8-9.5) | 5.33 | 8.28 | -108.25 | 0 | 5 | -2 | 89 | 370.455 | 4 | ↓ |