| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 11th, 2010 | 26 | Yes |
Popular Name: 1-[(5S)-2-chloro-5H-purin-6-yl]-N-(2-pyridylmethyl)piperidine-4-carboxamide 1-[(5S)-2-chloro-5H-purin-6-yl]-…
| 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) | 0.38 | 5.88 | -14.8 | 1 | 8 | 0 | 95 | 371.832 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.38 | 6.29 | -47.71 | 2 | 8 | 1 | 96 | 372.84 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
