In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 23rd, 2010 | 21 | Yes |
Popular Name: (2R)-3-isobutyl-2-(3-pyridyl)-1,2-dihydroquinazolin-4-one (2R)-3-isobutyl-2-(3-pyridyl)-1,…
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) | 2.03 | 7.64 | -12.79 | 1 | 4 | 0 | 45 | 281.359 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.03 | 7.92 | -44.46 | 2 | 4 | 1 | 46 | 282.367 | 3 | ↓ |