| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 11th, 2010 | 27 | Yes |
Popular Name: (3R)-1-[(5R)-2-chloro-5H-purin-6-yl]-N-(3-imidazol-1-ylpropyl)piperidine-3-carboxamide (3R)-1-[(5R)-2-chloro-5H-purin-6…
| 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) | 0.10 | 8.59 | -46.92 | 2 | 9 | 1 | 101 | 389.871 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.10 | 8.07 | -17.95 | 1 | 9 | 0 | 100 | 388.863 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
