In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 10th, 2008 | 30 | Yes |
Popular Name: (2R)-N-(m-tolyl)-2-[(4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)sulfanyl]butanamide (2R)-N-(m-tolyl)-2-[(4-oxo-5-phe…
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) | 6.04 | 10.37 | -20.07 | 2 | 5 | 0 | 75 | 435.574 | 6 | ↓ |
Hi High (pH 8-9.5) | 6.49 | 9.14 | -53.32 | 1 | 5 | -1 | 78 | 434.566 | 6 | ↓ |