In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 13th, 2011 | 26 | Yes |
Popular Name: (2R)-1-[2-(4-methyl-1-piperidyl)ethyl]-2-phenyl-2,3-dihydroquinazolin-4-one (2R)-1-[2-(4-methyl-1-piperidyl)…
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) | 3.80 | 10.58 | -54.72 | 2 | 4 | 1 | 37 | 350.486 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.80 | 8.33 | -9.33 | 1 | 4 | 0 | 36 | 349.478 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.