| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 7th, 2011 | 23 | Yes |
Popular Name: 3-[(1R)-2-[(3R,5R)-3,5-dimethyl-1-piperidyl]-1-methyl-ethyl]-1H-quinazoline-2,4-dione 3-[(1R)-2-[(3R,5R)-3,5-dimethyl-…
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| 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) | 2.71 | 9.43 | -29.54 | 2 | 5 | 1 | 59 | 316.425 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.17 | 7.76 | -29.23 | 1 | 5 | 0 | 62 | 315.417 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
