| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 27th, 2010 | 19 | Yes |
Popular Name: N1,N1-dimethyl-N4-[(5R)-5H-purin-6-yl]benzene-1,4-diamine N1,N1-dimethyl-N4-[(5R)-5H-purin…
| 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) | 1.16 | 5.38 | -37.05 | 0 | 6 | -1 | 67 | 253.289 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.16 | 5.94 | -9.42 | 1 | 6 | 0 | 65 | 254.297 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.16 | 6.14 | -47.55 | 1 | 6 | 0 | 68 | 254.297 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
