| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 18th, 2011 | 21 | Yes |
Popular Name: 8,9-dimethyl-6-(4-propylpiperazin-1-yl)purin-2-amine 8,9-dimethyl-6-(4-propylpiperazi…
| 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) | 1.58 | 9.41 | -41.14 | 3 | 7 | 1 | 77 | 290.395 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.58 | 7.19 | -10.33 | 2 | 7 | 0 | 76 | 289.387 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.58 | 9.05 | -87.29 | 4 | 7 | 2 | 79 | 291.403 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
