| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 23rd, 2008 | 24 | Yes |
Popular Name: 9-butyl-8-[(2-chloro-5-methoxy-phenyl)methyl]purin-6-amine 9-butyl-8-[(2-chloro-5-methoxy-p…
None
| 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) | 4.47 | 8.96 | -10.36 | 2 | 6 | 0 | 79 | 345.834 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 4.47 | 9.21 | -33.54 | 3 | 6 | 1 | 80 | 346.842 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 4.47 | 4.87 | -28.47 | 3 | 6 | 1 | 80 | 346.842 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
