In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2008 | 20 | Yes |
Popular Name: 2-[[(3R,5R)-3,5-dimethyl-1-piperidyl]methyl]-1H-quinazolin-4-one 2-[[(3R,5R)-3,5-dimethyl-1-piper…
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) | 2.52 | 7.6 | -47.68 | 2 | 4 | 1 | 50 | 272.372 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.98 | 6.58 | -33.72 | 1 | 4 | 0 | 53 | 271.364 | 2 | ↓ |