| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 14th, 2011 | 25 | Yes |
Popular Name: [(3S)-3-[(3-chlorophenyl)methyl]-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-3-piperidyl]methanol [(3S)-3-[(3-chlorophenyl)methyl]…
| 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) | 3.08 | 9.44 | -8.99 | 2 | 5 | 0 | 65 | 356.857 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.08 | 9.91 | -35.82 | 3 | 5 | 1 | 66 | 357.865 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![7H-pyrrolo[2,3-d]pyrimidine](http://zinc12.docking.org/img/rings/7073.gif)
![4-(3-benzylpiperidino)-7H-pyrrolo[2,3-d]pyrimidine](http://zinc12.docking.org/img/rings/25738.gif)