In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 25th, 2009 | 19 | Yes |
Popular Name: (2S)-2-[(5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carbonyl)amino]propanoic (2S)-2-[(5-methyl-4-oxo-3H-thien…
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) | -1.33 | 3.33 | -53.05 | 2 | 7 | -1 | 115 | 280.285 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.87 | 1.39 | -88.35 | 1 | 7 | -2 | 118 | 279.277 | 3 | ↓ |