In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 10th, 2008 | 31 | Yes |
Popular Name: (2S)-N-(m-tolyl)-2-[[4-oxo-5-(p-tolyl)-3H-thieno[2,3-d]pyrimidin-2-yl]sulfanyl]butanamide (2S)-N-(m-tolyl)-2-[[4-oxo-5-(p-…
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) | 6.49 | 11.12 | -21.08 | 2 | 5 | 0 | 75 | 449.601 | 6 | ↓ |
Hi High (pH 8-9.5) | 6.94 | 9.88 | -54.54 | 1 | 5 | -1 | 78 | 448.593 | 6 | ↓ |