In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 3rd, 2008 | 27 | Yes |
Popular Name: N,N-diallyl-2-[(4-oxo-1-phenyl-5H-pyrazolo[5,4-d]pyrimidin-6-yl)sulfanyl]acetamide N,N-diallyl-2-[(4-oxo-1-phenyl-5…
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) | 2.92 | 9.73 | -15.15 | 1 | 7 | 0 | 84 | 381.461 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.38 | 8.61 | -49.46 | 0 | 7 | -1 | 87 | 380.453 | 8 | ↓ |