In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 22nd, 2008 | 27 | Yes |
Popular Name: 2-[(1S)-1-methyl-2-oxo-2-phenyl-ethyl]sulfanyl-5-phenyl-3H-thieno[3,2-e]pyrimidin-4-one 2-[(1S)-1-methyl-2-oxo-2-phenyl-…
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) | 5.91 | 9.72 | -47.03 | 0 | 4 | -1 | 66 | 391.497 | 5 | ↓ |
Mid Mid (pH 6-8) | 5.45 | 10.97 | -15.6 | 1 | 4 | 0 | 63 | 392.505 | 5 | ↓ |
Mid Mid (pH 6-8) | 5.45 | 11.22 | -12.28 | 1 | 4 | 0 | 63 | 392.505 | 5 | ↓ |