| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 12th, 2011 | 28 | Yes |
Popular Name: 3-[1-[(4-fluorophenyl)methyl]-4-piperidyl]-1-[(1R)-1-(3-hydroxyphenyl)ethyl]-1-methyl-urea 3-[1-[(4-fluorophenyl)methyl]-4-…
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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) | 3.98 | 8.91 | -50.17 | 3 | 5 | 1 | 57 | 386.491 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.98 | 6.65 | -11.07 | 2 | 5 | 0 | 56 | 385.483 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
