| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 17th, 2011 | 23 | Yes |
Popular Name: (4R)-N-methyl-N-[[3-(4-pyridyl)isoxazol-5-yl]methyl]-4H-pyrrolo[2,3-d]pyrimidin-4-amine (4R)-N-methyl-N-[[3-(4-pyridyl)i…
| 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) | 1.10 | 4.26 | -13.47 | 0 | 7 | 0 | 80 | 306.329 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.10 | 4.71 | -46.93 | 1 | 7 | 1 | 81 | 307.337 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![4H-pyrrolo[2,3-d]pyrimidine](http://zinc12.docking.org/img/rings/397418.gif)
![[3-(4-pyridyl)isoxazol-5-yl]methyl-(4H-pyrrolo[2,3-d]pyrimidin-4-yl)amine](http://zinc12.docking.org/img/rings/407329.gif)