In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 6th, 2010 | 29 | Yes |
Popular Name: (2S)-2-(1-benzylpyrazol-4-yl)-3-(4-pyridyl)-1,2-dihydroquinazolin-4-one (2S)-2-(1-benzylpyrazol-4-yl)-3-…
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) | 3.00 | 10.06 | -17.9 | 1 | 6 | 0 | 63 | 381.439 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.00 | 10.52 | -44.82 | 2 | 6 | 1 | 64 | 382.447 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.