| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 11th, 2010 | 20 | No |
Popular Name: (4R)-N6-[(3,4-dichlorophenyl)methyl]-4H-purine-2,6-diamine (4R)-N6-[(3,4-dichlorophenyl)met…
| 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) | 1.51 | 3.92 | -9.26 | 3 | 6 | 0 | 88 | 309.16 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.51 | 2.88 | -32.56 | 2 | 6 | -1 | 90 | 308.152 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.51 | 3.76 | -9.64 | 3 | 6 | 0 | 91 | 309.16 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
