| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 15th, 2011 | 28 | Yes |
Popular Name: N-(2-bromo-4-isopropyl-phenyl)-9-[(1R)-1-ethylpentyl]-2-methyl-purin-6-amine N-(2-bromo-4-isopropyl-phenyl)-9…
| 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) | 7.96 | 15.93 | -9.09 | 1 | 5 | 0 | 56 | 444.421 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 7.96 | 15.54 | -23.77 | 2 | 5 | 1 | 57 | 445.429 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
