In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 22 | Yes |
Popular Name: 6-acetyl-5-methyl-2-[[(2S)-2-methyl-1-piperidyl]methyl]-3H-thieno[2,3-d]pyrimidin-4-one 6-acetyl-5-methyl-2-[[(2S)-2-met…
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) | 2.40 | 8.25 | -52.49 | 2 | 5 | 1 | 67 | 320.438 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.86 | 5.58 | -42.24 | 1 | 5 | 0 | 70 | 319.43 | 3 | ↓ |