In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 29th, 2008 | 25 | Yes |
Popular Name: N-[(7R)-5-oxo-7-phenyl-6,7-dihydro-1H-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]benzamide N-[(7R)-5-oxo-7-phenyl-6,7-dihyd…
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) | 1.88 | 10.81 | -16.42 | 2 | 7 | 0 | 89 | 333.351 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.07 | 8.79 | -58.48 | 1 | 7 | -1 | 95 | 332.343 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.06 | 10.26 | -53.38 | 1 | 7 | -1 | 90 | 332.343 | 3 | ↓ |